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学位 Mesoscopic Thermodynamics based on Quantum Information Theory づくメゾスコピック 学) 26 12 学) 大学大学院 March 5, 2015

学位論文 Mesoscopic Thermodynamics based on …hatano-lab.iis.u-tokyo.ac.jp/thesis/dron2014/thesis...Introduction Thermodynamics started as a study that clarifies the upper limit

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Page 1: 学位論文 Mesoscopic Thermodynamics based on …hatano-lab.iis.u-tokyo.ac.jp/thesis/dron2014/thesis...Introduction Thermodynamics started as a study that clarifies the upper limit

学位論文

Mesoscopic Thermodynamics

based on Quantum Information Theory

(量子情報理論に基づくメゾスコピック系の熱力学)

平成 26年 12月博士(理学)申請

東京大学大学院理学系研究科

物理学専攻

田島 裕康

March 5, 2015

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Abstract

The current research situation surrounding the small-size heat engines looks almost exactly like the one in 1700s

surrounding the macroscopic heat engines, on the night before the appearance of thermodynamics. The devel-

opment of experimental techniques is realizing micro-machines in laboratories, and is clarifying the functions of

bio-moleculars which are micro-machines in nature. The development of theoretic analysis is also achieving a

splendid success both in the microscopic and macroscopic limits. However, no theoretical study has sufficiently

discussed thermodynamic laws in mesoscopic scales, where the number of particles is not so small but finite.

There is also a problem in the formulation of quantum heat engines themselves; there are various formulations,

but the relation among them has not been clarified.

The present thesis is devoted to reconsider the above two problems, using the quantum information theory.

First, we reconsider the formulation for quantum heat engines by using quantum measurement theory. We give

a trade-off inequality which means that we have to destroy the coherence of the thermodynamic system in order

to know the amount of the extracted energy; namely, a work extraction must be a measurement. Based on the

fact, we formulate the work extraction as a measurement process, and clarify the previous formulations in our

framework.

Second, we assess how accurately thermodynamics gives an approximation to the optimal efficiency of heat

engines composed of a finite-particle working body and finite-particle heat baths, by using large deviation

theory. We microscopically derive a thermodynamical upper bound for the efficiency of finite-size heat engines

with two heat baths that are composed of n identical particles. It is not the upper limit, but we can obtain

an asymptotic approximation of the upper limit by expanding our upper bound asymptotically in terms of

qn := QH,n/n, where QH,n is the extracted heat from the hot bath. In the case that the heat baths’ particle

are uncorrelated each others, the asymptotic expansion of our upper bound approximates the optimal efficiency

up to the first order of qn in general, and up to the second order of q2n in the case that QH,n is non-decreasing

of n; there exists a thermodynamic operation whose asymptotic expansion of efficiency coincides with that of

our upper bound up to the orders.

2

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Publication List

Journal Articles

(i) H. Tajima, ”Deterministic LOCC transformation for three qubit pure states,” Annals of Physics, 329,

1-27, (2013). (contains results presented in Appendix B)

(ii) H. Tajima, ”Second law of information thermodynamics with entanglement transfer,” Physical Review

E, 88, 042143 (2013). (contains results presented in Chapter 2)

Proceedings

(iii) H. Tajima, ”A New Second Law of Information Thermodynamics Using Entanglement Measure,” JPS

Conference Proceedings, 1, 012129 (2014). (contains results presented in Chapter 2)

Submitted

(iv) H. Tajima, ”Minimal energy cost of thermodynamic information processes only with entanglement

transfer,” arXiv:1311.1285, (2013). (contains results presented in Chapter 2)

(v) H. Tajima and M. Hayashi, ”Refined Carnot ’s Thereom; Asymptotics of Thermodynamics with

Finite-Size Heat Baths,” arXiv:1405.6457, (2014). (contains results presented in Chapter 4)

In preparation

(vi) H. Tajima and M. Hayashi, ”Work extraction as a measurement process.” (contains results presented

in Chapter 3)

3

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Contents

1 Introduction 7

2 Review of Thermodynamics in Quantum systems 11

2.1 Statistic derivation of principle of maximum work . . . . . . . . . . . . . . . . . . . . . . . . . . . 11

2.2 Information Thermodynamics . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 13

2.2.1 Second law with feedback control . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 13

2.2.2 Lower bounds of energy costs for information processes . . . . . . . . . . . . . . . . . . . 14

2.3 Entanglement Description of Information Thermodynamics . . . . . . . . . . . . . . . . . . . . . 17

2.3.1 Entanglement transfer during the measurement . . . . . . . . . . . . . . . . . . . . . . . . 18

2.3.2 Second law of information thermodynamics with entanglement gain . . . . . . . . . . . . 20

2.3.3 Energy costs of the information processes . . . . . . . . . . . . . . . . . . . . . . . . . . . 21

2.4 Achievability of the equality of the principle of maximal work . . . . . . . . . . . . . . . . . . . . 23

2.4.1 Setup and the thermodynamical quantities . . . . . . . . . . . . . . . . . . . . . . . . . . 23

2.4.2 Isothermal operation . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23

2.4.3 The second law . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 24

2.4.4 The achievability of the equality of the principle of maximal work . . . . . . . . . . . . . 24

3 Work Extraction as a Measurement Process 27

3.1 A Contradiction between Two Scenarios for Work Extraction . . . . . . . . . . . . . . . . . . . . 27

3.1.1 The answer to Question 1: an example of the set {VIEX, ρEX

, HEX} . . . . . . . . . . . . 28

3.1.2 The answer to Question 2: the trade-off relation . . . . . . . . . . . . . . . . . . . . . . . 30

3.2 Work extraction as a measurement process . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 33

3.2.1 CP-work extraction . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 33

3.2.2 FQ-work extraction . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 36

3.3 Converse mapping from the CPSU-work extraction to the FQSM-work extraction . . . . . . . . . 40

3.3.1 Fully classical model . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40

3.3.2 Converse mapping from the CPSU-work extraction to the FQSM-work extraction . . . . . 42

3.3.3 Relationship between our scenario and semi-classical scenario . . . . . . . . . . . . . . . . 43

4 Finite-size Thermodynamics 47

4.1 Carnot’s Theorem for finite-size systems . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 47

4.1.1 Heat engine with n-particle heat baths . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 47

4.1.2 Upper bound for the efficiency of heat engines with n-particle heat baths . . . . . . . . . 48

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4.1.3 Accuracy of thermodynamics in finite-size systems . . . . . . . . . . . . . . . . . . . . . . 50

4.1.4 Effect of finiteness of the working body . . . . . . . . . . . . . . . . . . . . . . . . . . . . 51

4.2 Proof . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 51

4.2.1 Rough Sketch . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 51

4.2.2 Abbrebiations . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55

4.2.3 Derivation of the general upper bound . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55

4.2.4 Relation with cumulant generating function . . . . . . . . . . . . . . . . . . . . . . . . . . 58

4.2.5 Taylor expansion of the general upper bound . . . . . . . . . . . . . . . . . . . . . . . . . 60

4.2.6 Asymptotic expansion of efficiency η(n)(Tmn) . . . . . . . . . . . . . . . . . . . . . . . . . 61

5 Summary and future works 71

A The comparison (2.16) with (2.65) in terms of achievability 73

B Deterministic LOCC transformation of three-qubit pure states 77

B.1 Theorems and their physical meanings . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 77

B.2 Proof of Theorem 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 83

B.3 The Proof of Theorem 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85

B.3.1 Case A . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85

B.3.2 Case B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89

B.3.3 Case C . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96

B.3.4 Case D . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 97

C Thermodynamical derivation of (4.7) 101

Acknowledgements 103

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Chapter 1

Introduction

Thermodynamics started as a study that clarifies the upper limit of the efficiency of macroscopic heat engines [1]

and has become a huge realm of science which covers from electric batteries [2] to black holes [3]. Today, with

the development of experimental techniques, the studies of thermodynamics are reaching a new phase. Probing

and manipulating small-size systems has become possible, and now we are able to verify thermodynamic features

of microscopic and mesoscopic systems [4–6].

However, there is no guarantee that we can apply the standard thermodynamics to the small-size heat

engines as it is, because it is a phenomenology for macroscopic systems. The small-size heat engines have been

studied by the statistical mechanical approachs, in which we formulate a heat engine as a crowd of particles,

and analyze it [7–37]. The statistical mechanical approach has achieved splendid success in the following three

topics;

statistic derivation of thermodynamical inequalities [7–12]

There are many results according to the statistic derivation of thermodynamic inequalities in classical

and quantum systems. For quantum heat engines, Tasaki [8] has derived the principle of maximum work

statistically. While he did not show the existence of the optimal operation which achieves the equality of

the principle of maximum work. In 2014, Skrzypczyk, Short, and Popescu [12] showed the the principle

of maximum work including its achievability in another setup.

Thermodynamic laws for processes with measurement and feedback [13–31]

When we perform measurement and feedback on a thermodynamical system, the second law of thermo-

dynamics appears to be violated. This well-known fact was pointed out by Maxwell [13], and numerous

studies have long been conducted on it [14–31]. Szilard [14] has pointed out that the violation is related

to the information content, and Sagawa and Ueda [25] gave an upper bound of the extracted work by

a thermodynamic process with measurement and feedback by generalizing Szilard’s idea. Sagawa and

Ueda [15] also gave a lower bound of the energy cost of the measurement and information erase process,

by generalizing Landauer’s principle.

Thermodynamic laws for the nano scale working bodies [32–37]

Many researches recently reported how the finiteness of the working body affects the thermodynamic

laws for microscopic systems by statistical mechanical methods [32–37]. The key concept in Refs. [33–36]

is the smooth entropy [43, 44], which is an extension of the Shannon entropy, and that in Ref. [37] is the

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entanglement catalyst theory [45], which is an important result in quantum information theory. In these

results, the extractable amount of work by single-shot extraction from a microscopic system connected to

a heat bath was given as a function of the failure probability [33,35,36] and criteria for “thermodynamic

state transitions” were given [33,37]. When the initial state of the system is ρ⊗n, that is when the system

is composed of uncorrelated identical particles, these results reduce to the principle of maximum work in

the limit n → ∞.

However, in spite of these important progresses, the following two theoretical problems remain in the statis-

tical mechanical approach.

・ There is no quantitative understanding of thermodynamic laws for the systems whose number of particle is

not so small but finite. In other words, we do not know thermodynamic laws in mesoscopic realms. The

smooth entropy is a very general tool, but it is very difficult to compute, and thus it gives only formal

solutions in such cases.

・ The concept of the work extraction from the quantum systems is very subtle, and no consensus has been

reached [38]. The previous researches on quantum systems [8–12, 25–31, 33–37] have been formulated in

various ways, and the relationship among the formulations has not been sufficiently discussed. The

formulations are roughly classified in the semi-classical scenario [8–10, 25–30] and the fully quantum

scenario [11, 12, 31, 33–37]. In the semi-classical scenario, the heat engine and the heat baths evolutes in

time unitarily, under a time-dependent Hamiltonian which is controlled by the classical external system.

In the fully quantum scenario, the heat engine, the heat baths and the quantum external system time

evolutes unitarily such that the energy of total system conserves. Whereas it has been expected that the

fully quantum scenario converges to the semi-classical scenario in a proper approximation, neither the

proof nor the counterproof for the expectation has been given.

The main theme of the present thesis is to revisit the above two problems and to give a useful method to

analyze the thermodynamical features of the mesoscopic systems, based on the quantum information theory.

First, we reconsider the formulation for quantum heat engines by using quantum measurement theory [41, 42]

and show that there is a serious conflict between the semi-classical scenario and the fully quantum scenario. To

be specific, as soon as we request the condition that we can know the amount of the extracted work by observing

the work storage, we become unable to describe the time evolution as a unitary time evolution. This fact is

given as a trade-off inequality which means that we have to destroy the coherence of the thermodynamic system

in order to know the amount of the extracted energy; namely, a work extraction must be a measurement. Based

on the fact, we give a several classes of the energy transfer from the internal system to the external system,

whose elements satisfies the features which a work extraction should satisfy.

Second, we give a quantitative method to calculate the efficiency for heat engines in mesoscopic scales, and

assess how accurately thermodynamics gives an approximation to the optimal efficiency. In order to overcome

the problem of finitely large values of the particle number n, we need more detailed analytical tools than the

smooth entropy; namely, the information geometry [59] and the strong large deviation theory [46, 47]. Using

the information geometry, we microscopically rederive a thermodynamical upper bound for the efficiency of

finite-size heat engines with two heat baths that are composed of n identical particles. Next, we asymptotically

expand the upper bound in terms of qn := QH,n/n, where the QH,n is the extracted heat from the hot heat

bath. In the case that the heat baths’ particle are uncorrelated each others, we can construct a specific work

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extraction whose efficiency coincides with the upper bound up to the term of the first order qn in general cases,

and up to the term of the second order q2n in the case that QH,n is non-decreasing of n,; namely, thermodynamics

gives an approximation to the optimal efficiency which is accurate up to the the order of qn in general, and up

to the order of q2n in the case that QH,n is non-decreasing of n, respectively.

The present thesis is organized as follows. In Chapter 2, we review the previous results which are closely

related to our results. In Chapter 2 particulary in Subsection 2.3, we also review three of the author’s results,

which give the entanglement description of the information thermodynamics. They correspond to Refs. [28–30].

In Chapter 3, we reconsider the formulation of heat engines, and give the work extraction as a measurement

process. The results in Chapter 3 is based on Ref. [39] under collaboration with Prof. M. Hayashi. In Chapter

4, we give a theory of the efficiency of heat engines in mesoscopic scale. The results in Chapter 4 are based

on Ref. [40] under collaboration with Prof. M. Hayashi. In Chapter 5, we summarize the present thesis, and

discuss future works. In Appendix A, we give the detail of a lemma in Subsection 2.3. In Appdendix B, we give

one of the author’s results, which corresponds to Ref. [62]. It gives a necessary and sufficient condition for the

possibility of deterministic LOCC transformation and is used in Appendix A.

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Chapter 2

Review of Thermodynamics in

Quantum systems

Various approaches have been devised for statistic analyses of the quantum heat engines.

These studies model the heat engines and the heat baths as a mass of quantum particles, and analyze their

thermodynamic features. In the present chapter, we review the studies focusing on the work extraction from

quantum heat engines.

2.1 Statistic derivation of principle of maximum work

In Sections 2.1, 2.2 and 2.3, we review the semi-classical work extraction scenario [8–10,25–30]. In this scenario,

we consider the work extraction from quantum systems by a classical external system; we assume the energy

loss of the internal system under a unitary time evolution to be the extracted work. Under the assumption,

Tasaki derived the principle of the maximum work in 2000 [8]. In the present section, we review the derivation.

As the set up, let us consider a thermodynamic system S that is in contact with a heat bath B at temperature

T . We express the Hamiltonian of the whole system as

H(λ(t)) = HS(λS(t)) + HSB(λSB(t)) + HB , (2.1)

where the first term is the Hamiltonian of the system S, the third term is that of the bath B, the second term is

the interaction Hamiltonian between the system them, and where λS(t) and λSB(t) are the external paramters.

In the above setup, we perform a thermodynamic operation as a unitary time evolution. We control the

external parameters time-dependently, and perform the unitary time evolution U = T→ exp(−i∫

H(λ(t))dt) on

the composit system SB, from t = 0 to t = τ . We assume that the system S is detached from B initially and

finally; HSB(λSB(0)) = HSB(λSB(τ)) = 0. We also assume that the initial state ρi of SB is the Gibbs state at

the inverse temperature β := 1/kBT ;

ρi =exp(−βHS

i )ZS(HS

i , β)⊗ exp(−βHB)

ZB(β), (2.2)

where HSi = HS(λS(0)), ZS(HS

i , β) = tr[exp(−βHS)] and ZB = tr[exp(−βHB)].

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During the time evolution, the energy is transmitted to the external operator through the back reaction of

the control parameter, and we assume the energy loss to be the extracted work:

W (U) := tr[Hiρi − Hfρf ], (2.3)

where Hi := HSi + HB , Hf := HS(λS(τ)) + HB and ρf := UρiU

†. We further assume that we can realize a

thermodynamic equilibrium state at temperature T by connecting S and B and waiting.

Then, as we show below, the principle maximum work holds:

W (U) ≤ −∆FS(β), (2.4)

where

∆FS(β) := FS(HSf , β) − FS(HS

i , β), (2.5)

FS(HS , β) := − 1β

log ZS(HS , β). (2.6)

Note that the Helmholtz free energy FS(Hf , β) does not depend on the final state ρf . Since we have assume

that we can realize a thermodynamic equilibrium state at temperature T by connecting S and B and waiting,

we can regard F (Hf , β) as the Helmholtz free energy of the final state. The equilibrium state may not be the

Gibbs state, but just a macroscopic equilibrium state. In the subsections 2.2 and 2.3, we need the assumption

in order to treat F (Hf , β) as the Helmholtz free energy of the final state. Because this assumption is not related

to the proof of (2.13), the inequality (2.4) holds whether the assumption holds or not.

Proof : Note that for an arbitrary Gibbs state ρG,β(H) := exp(−βH)/Z(H,β) with an arbitrary Hamiltonian

H, the following equality holds;

H = − 1β

log ρG,β(H) + F (H,β). (2.7)

Using (2.7) and S(ρ) := −tr[ρ log ρ], we convert W (U) in (2.3) as follows;

W (U) := tr[Hiρi − Hfρf ] (2.8)(a)= tr

[(− 1

βlog ρi + F (Hi, β)

)ρi −

(− 1

βlog ρG,β(Hf) + F (Hf , β)

)ρf

](2.9)

=1β

S(ρi) + F (Hi, β) − F (Hf , β) +1β

tr[ρf log ρG,β(Hf)] (2.10)

(b)=

S(ρi) + F (Hi, β) − F (Hf , β) − 1β

S(ρf) −1β

D(ρf∥ρG,β(Hf)) (2.11)

=1β

S(ρi) + FS(HSi , β) + FB(HB , β) − FS(HS

f , β) − FB(HB , β) − 1β

S(ρf) −1β

D(ρf∥ρG,β(Hf))

=1β

(S(ρi) − S(ρf)) − ∆FS(β) − 1β

D(ρf∥ρG,β(Hf)) (2.12)

(c)

≤ 1β

(S(ρi) − S(ρf)) − ∆FS(β), (2.13)

where D(ρ∥σ) := Tr[ρ(log ρ− log σ)], and where the equality (a) follows from (2.7), the equality (b) follows from

tr[ρ log σ] = −S(ρ) − D(ρ∥σ), and the inequality (c) follows from D(ρ∥σ) ≥ 0. Because of S(ρi) = S(ρf), the

inequality (2.13) yields (2.4). ¤

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2.2 Information Thermodynamics

2.2.1 Second law with feedback control

In 2008, Sagawa and Ueda extended the above derivation of the principle of maximum work and derived an

extended second law for the thermodynamic operation with feedback control [25]. In the present subsection, we

review the result in Ref. [25].

We use the same setup as in the section 2.11 and perform the isothermal operation with feedback control

as follows.

Isothermal operation with feedback control

Step 1: We control the external parameter λ(t) of the Hamiltonian (2.1) and perform the thermodynamic

operation U := T→ exp(−i∫

H(λ(t))dt) on the initial state (2.2) of the composit system SB. When

Step 1 finishes, the state of SB becomes ρ1 := UρiU†.

Step 2: We perform a CP-instrument {Ej} on S, where each Ej is a complete positive map, and∑

j Ej

is a completely positive and trace preserving(CPTP) map. When Step 2 finishes, the state of SB

becomes ρj2 := Ej(ρ1)/pj with probability pj := tr[Ej(ρ1)].

Step 3: We perform the feedback control U(j) := T→ exp(−i∫

H(λj(t))dt) depending on the outcome j

of {Ej}. When Step 3 finishes, the state of SB becomes ρjf := U(j)Ej(ρ1)U

†(j)/pj . We assume that

the Hamiltonian of SB is the same for every j at the end of Step 3;

Hf := HSf + HB . (2.14)

For the above thermodynamic operation with feedback control, we define the extracted work as

Wfb := tr[Hiρi −∑

j

pjHfρjf ]. (2.15)

Then, as we show below, the extended principle maximum work holds:

Wfb ≤ −∆FS(β) +1β

IQC, (2.16)

where

IQC := S(ρ1) −∑

j

pjS(ρj2). (2.17)

The quantity IQC was introduced by Sagawa and Ueda, and called the QC-mutual information content.

Sagawa and Ueda pointed out that the QC-mutual information content IQC satisfies the following features and

defined IQC as the information content obtained by the measurement {Ej};

・ When the measurement {Ej} is classical, i.e., for the spectral decomposition ρ1 =∑

i qi|ψi⟩⟨ψi| with or-

1In Ref. [25], Sagawa and Ueda treat not only one heat bath B, but also many heat baths {Bm}nm=1. However, the essence can

be seen in the case of n = 1, and thus we treat only the case of n = 1 for simplicity.

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thonormal basis {|ψi⟩}i, each CP-map Ej satisfies

Ej(ρ1) =∑

j

qi,j

pj|ψi|j⟩⟨ψi|j |, where qi,j := tr[Ej(|ψi⟩⟨ψi|)] (2.18)

with proper orthonomal basis {|ψi|j⟩}i, IQC reduces to the classical mutual information;

IQC =∑i,j

qi,j logqi,j

qipj. (2.19)

・ The QC-mutual information content IQC depends only on the premeasurement state ρ1 and the CP-

instrument {Ej}.

From the above point of view, the inequality (2.16) means that in the thermodynamic processes with feedback

control, the extracted work can exceed the conventional second law by the amount of the information extracted

by the measurement. Note that the quantity IQC is determined when the measurement is finished. Regardless

of the feedback control {Uj}, the surplus Wfb − (−∆F ) is bounded by the QC-mutual information IQC.

Proof of (2.16): In the same way as the derivation of (2.13), we can convert Wfb as follows;

Wfb := tr[Hiρi −∑

j

pjHfρjf ] (2.20)

= tr

(− 1

βlog ρi + F (Hi, β)

)ρi −

∑j

pj

(− 1

βlog ρG,β(Hf) + F (Hf , β)

)ρjf

(2.21)

=1β

S(ρi) + F (Hi, β) −∑

j

pj

(F (Hf , β) − 1

βtr[ρj

f log ρG,β(Hf)])

(2.22)

=1β

S(ρi) + F (Hi, β) −∑

j

pj

(F (Hf , β) +

S(ρjf ) +

D(ρjf ∥ρG,β(Hf))

)(2.23)

=1β

S(ρi) + FS(HSi , β) + FB(HB , β)∑

j

pj

(FS(HS

f , β) + FB(HB , β) +1β

S(ρjf ) +

D(ρjf ∥ρG,β(Hf))

)=

IQC − ∆FS(β) − 1β

∑j

pjD(ρjf ∥ρG,β(Hf)) (2.24)

≤ −∆FS(β) +1β

IQC. (2.25)

¤

2.2.2 Lower bounds of energy costs for information processes

In the subsection 2.2.1, we derived an upper bound of the extracted work of a thermodynamic operation with

feedback control. The essence of the derivation was the relations (2.7) and tr[ρ log σ] = −S(ρ) − D(ρ∥σ). By

using these two relations, Sagawa and Ueda also derived a lower bound of energy costs for a measurement and

an information erase [27]. In the present subsection, we review the result in Ref. [27].

As the setup, let us consider a thermodynamic system S and a memory M which is connected to a heat bath

BM . The thermodynamic system S is the target of the measurement. The memory M stores the information

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on the outcomes of the measurement. The heat bath BM is at a temperature T and is in contact with M .

In order to use M as the memory, we divide HM , which is the Hilbert space of M , into mutually orthogonal

subspaces HM(k) (k = 0, ..., N), where the subscripts k specify the measurement outcomes; HM = ⊕N

k=0HM(k). We

consider the outcome k to be stored in M when the support of the density operator of M is in HM(k). Without

losing generality, we can assume that k = 0 corresponds to the standard state of M .

In order to consider a measurement process and an information erase process as isothermal processes, we

assume that the memory M and the heat bath BM keep interacting with each other during these processes. In

each process, the Hamiltonian of the composit system MBM is written as follows;

HMBmeas(t) = HM

meas(t) + H intmeas(t) + HBM , (2.26)

HMBeras (t) = HM

eras(t) + H interas(t) + HBM , (2.27)

where H intmeas(t) and H int

eras(t) are the interaction Hamiltonians between M and B. We consider the measurement

process from t = tmeasini to t = tmeas

fin and the erase process from t = terasini to t = terasfin . At the initial and final

times of the processes, the Hamiltonians H intmeas(t) and H int

eras(t) become 0, and the the Hamiltonians HMmeas(t)

and HMeras(t) become ⊕kHM

(k) := ⊕k

∑i ϵki |ϵki⟩ ⟨ϵki|, where {|ϵki⟩}i is an orthonormal basis of HM

(k).

Under the above setup, we consider the measurement process and the information erase process as follows:

Measurement Process

Initial state At t = tmeasini , the composit system SMBM is in the following initial state:

ρmi ≡ ρS

ini ⊗ ρG,β(HM0 ) ⊗ ρG,β(HBM ). (2.28)

Note that ρSini is an arbitrary state of S.

Step M1 As the former part of the measurement on S, we perform a unitary transformation USMBM

on SMBM from t = tmeasini to t = tmeas

1 . When Step M1 is completed, the state of SMBM becomes

ρm1 := USMBM

ρmi U†

SMBM.

Step M2 As the latter part of the measurement on S, we perform a projective measurement P(k) ≡∑i |ϵki⟩ ⟨ϵki| on M from t = tmeas

1 to t = tmeas2 . When Step M2 is completed, the state of SMBM

becomes ρm(k),2 := P(k)ρ

m1 P(k)/p(k) with the probability p(k) := tr[P(k)ρ

m1 P(k)]. We also assume that

each ρm(k),2 does not have the correlation between S and MB; namely, ρm

(k),2 = ρS(k) ⊗ ρMBM

(k) holds,

where ρS(k) := trMBM

[ρm(k),2] and ρMBM

(k) := trS [ρm(k),2].

Energy cost We introduce the average energy cost WMmeas which is necessary for the measurement process

as

WMmeas ≡

∑k

pktr[ρMB(k) (HM

k + HBM )] − tr[ρG,β(HM0 ) ⊗ ρG,β(HBM )(HM

0 + HBM )]. (2.29)

We also define the average difference of the Helmholtz free energy:

∆FMmeas ≡

∑k

p(k)F (HMk , β) − F (HM

0 , β). (2.30)

Information Erase Process

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Initial state At t = terasini , the composit system MBM is in ρei :=

∑k p(k)ρ

e(k), where ρeM

(k) = trBM[ρe

(k)]

belongs to HMk for each k.

Step E1 From t = terasini to t = terasfin , we perform the unitary transformation UMBM such that tr[P(k)ρef ] = 0

for any k = 0, where ρef := UMBM

ρei U

†MBM

.

Energy cost We define the energy cost which is necessary for the above process as

WMeras ≡ tr[ρe

f (HM + HBM )] − tr[ρe

i (HM + HBM )]. (2.31)

We also define the average change of the Helmholtz free energy as

∆FMeras ≡ F (HM

0 , β) −∑

k

pkF (HMk , β). (2.32)

For the above two information processes, the following three inequalities hold;

WMmeas ≥ ∆FM

meas +1β

(IQC − H{p(k)}), (2.33)

WMeras ≥ −∆FM

eras +1β

H{p(k)} if ρe(k) = ρG,β(HM

k + HBM ), (2.34)

WMmeas + WM

eras ≥ 1β

IQC if ρe(k) = ρm

(k),2. (2.35)

where

IQC := S(ρSini) −

∑k

pkS(ρS(k)), (2.36)

H{p(k)} := −∑

k

p(k) log p(k). (2.37)

By combining (2.16) and (2.35), we recover the second law of the total system is recovered;

Wtot := W (U, {Ej , Uj}) − WMmeas − WM

eras ≤ −∆FS(β) = −∆FSM (β). (2.38)

Proof: We first prove (2.33). In the same way as the derivations of (2.13) and (2.25), we can convert WMmeas

as follows;

WMmeas ≡

∑k

pktr[ρMB(k) (HM

k + HB)] − tr[ρG,β(HM0 ) ⊗ ρG,β(HBM )(HM

0 + HB)] (2.39)

=∑

k

pktr[ρMB(k) (− 1

βlog ρG,β(HM

k + HB) + F (HMk , β) + F (HB , β))]

−tr[ρG,β(HM0 + HBM )(− 1

βlog ρG,β(HM

0 + HB) + F (HM0 , β) + F (HM , β)] (2.40)

= ∆FMmeas +

(∑k

pkS(ρMBM

k ) − S(ρG,β(HM0 + HBM ))

)

+1β

∑k

pkD(ρMB(k) ∥ρG,β(HM

k + HB)) (2.41)

≥ ∆FMmeas +

(∑k

pkS(ρMBM

k ) − S(ρG,β(HM0 + HBM ))

). (2.42)

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Thus, in order to prove (2.33), we only have to prove the following inequality;

∑k

pkS(ρMBM

k ) − S(ρG,β(HM0 + HBM )) ≥ IQC − H{p(k)}. (2.43)

We obtain (2.43) as follows;

∑k

pkS(ρMBM

k ) − S(ρG,β(HM0 + HBM )) − IQC + H{p(k)} (2.44)

(a)=

∑k

pkS(ρMBM

k ) − S(ρG,β(HM0 + HBM )) +

∑k

pkS(ρS(k)) − S(ρS

ini) + H{p(k)} (2.45)

(b)=

∑k

pkS(ρMBM

k ⊗ ρS(k)) − S(ρG,β(HM

0 + HBM ) ⊗ ρSini) + H{p(k)} (2.46)

(c)=

∑k

pkS(ρm(k),2) − S(ρm

i ) + H{p(k)} (2.47)

(d)= S(

∑k

pkρm(k),2) − S(ρm

i ) = S(∑

k

Pkρm1 Pk) − S(ρm

1 ) ≥ 0, (2.48)

where the equality (a) follows from the definition of IQC, the equality (b) follows from S(ρ⊗ σ) = S(ρ) + S(σ),

the equality (c) follows from the assumption ρm(k),2 = ρMBM

(k) ⊗ ρS(k), and the equality (d) follows from the fact

that S(∑

k pkρk) = H{pk} +∑

k pkS(ρk) holds when the supports of ρk are orthogonal to each other.

Next, we prove (2.34) and (2.35). In the same way as the derivation of (2.42), we can convert WMeras as

follows;

WMeras = ∆FM

eras +1β

(S(ρe

f ) −∑

k

pkS(ρe(k))

)

+1β

D(ρef ∥ρG,β(HM

0 + HBM )) − 1β

∑k

pkD(ρe(k)∥ρG,β(HM

k + HBM )). (2.49)

Because the supports of ρe(k) are orthogonal to each other, the following equation holds;

S(ρef ) −

∑k

pkS(ρe(k)) = S(

∑k

pkUMBρe(k)U

†MB) −

∑k

pkS(ρe(k)) (2.50)

= H{pk} +∑

k

pkS(UMBρe(k)U

†MB) −

∑k

pkS(ρe(k)) = H{pk}. (2.51)

Thus,

WMeras ≥ ∆FM

eras +1β

H{pk} −1β

∑k

pkD(ρe(k)∥ρG,β(HM

k + HBM )) (2.52)

holds. When ρe(k) = ρG,β(HM

k +HBM ) holds, (2.52) clearly yields (2.34), because of D(ρe(k)∥ρG,β(HM

k +HBM )) =

0. When ρe(k) = ρm

(k),2 holds, then (2.35) follows from (2.41), (2.43) and (2.52). ¤

2.3 Entanglement Description of Information Thermodynamics

In the previous section 2.2, we have reviewed the information thermodynamics which was given by Sagawa and

Ueda [25,27]. The point is the following two statements. In the thermodynamic processes with feedback control,

the extracted work can exceed the conventional second law by the product of the temperature and the amount

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of the information extracted by the measurement, which is measured by the QC-mutual information IQC. On

the other hand, the sum of the energy costs for the measurement and the information erase is larger than or

equal to the product.

The QC-mutual information content IQC is determined when the measurement process is completed. How-

ever, the measurement process consists of the two steps: the first step is the unitary interaction U between the

system S and the memory M ; the second step is the projective measurement on the memory M . Because the

second step is independent of the time evolution of S, the information extraction in the measurement process

must be finished at the end of the first step. Based on the above consideration, the author has defined the

amount of the entanglement gain which is caused by the unitary interaction U between the system S and the

memory M , in 2013 [28]. We can understand the amount of the entanglement gain as the “fresh” informa-

tion and also understand the projective measurement on the memory as an interpretation process of the fresh

information.

In the present section, we review the author’s results in Refs. [28–30]: we define the amount of the entan-

glement gain [28, 30] in Subsection 2.3.1; we give an upper bound of the extracted work of the information

thermodynamic process with the entanglement gain [28] in Subsection 2.3.2; we give an lower bound for the

energy cost of the information processes [29] in Subsection 2.3.3. The difference between the entanglement

gain and IQC is clear especially in the bounds for the energy cost of information processes; the bounds with

the entanglement gain are strictly tighter than (2.33), (2.34) and (2.35). This fact stands for the essential

irreversibility of the information thermodynamics. In particular, when the measurement is not classical, the

sum of the energy costs for the measurement and the information erase is strictly larger than the energy profit

by the feedback control.

2.3.1 Entanglement transfer during the measurement

When we perform the CP-instrument {Ej} on the system A, the premeasurement state ρA changes to the state

Ej(ρA)/pj with the probability pj := tr[Ej(ρA)]. We also take a proper reference system R to have a proper

pure state |ψAR⟩ such that trR[|ψAR⟩⟨ψAR|] = ρA. Then, we define the entanglement gain −∆EA−RF as follows;

−∆EA−RF := EA−R

F (|ψAR⟩⟨ψAR|) − EA−RF (

∑j

Ej ⊗ 1R(|ψAR⟩⟨ψAR|)), (2.53)

where EA-RF (ρ) is the entanglement of formation [54] between A and R;

EA-RF (ρ) ≡ min

ρ=P

ql|φl⟩⟨φl|

∑l

qlEA-R(

∣∣φl⟩) (2.54)

with EA-R(∣∣φl

⟩) being the entanglement entropy [53] between A and R for a pure state

∣∣φl⟩.

Let us see that the quantity −∆EA−RF means the amount of the entanglement gain. Let the set (HM, ρM , U, {Pj})

be the indirect measurement model which yields the CP-instrument {Ej}. We also take another reference system

RM to obtain a proper pure state |φMRM⟩ such that trRM

[|φMRM⟩⟨φMRM

|] = ρM . Then, the premeasurement

state of the total system is given by

|ψAR⟩ ⊗ |φMRM ⟩. (2.55)

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Because of ∑j

Ej ⊗ 1R(|ψAR⟩⟨ψAR|) = trMRM [U(|ψAR⟩ ⊗ |φMRM ⟩⟨ψAR| ⊗ ⟨φMRM |)U†], (2.56)

we can express (2.53) as follows:

−∆EA-RF = EA-R

F |before U − EA-RF |after U . (2.57)

During the unitary interaction U between A and M which is the first half step of the measurement Ej , the amount

of the entanglement between AM and MRM does not change, because the entanglement does not change by the

local unitary transformation. On the other hand, the quantity −∆EA−RF is the loss of entanglement between A

and R, which is caused by U . Thus, we can interpret −∆EA−RF as the amount of the entanglement gain which

is taken from the system A by the memory M during the interaction U .

Because −∆EA−RF is defined by {Ej}, the indirect measurement models which yield the same CP-instrument

all produce the same value of −∆EA−RF . Namely, the measurements whose QC-mutual informations are the

same have the same value of −∆EA−RF . However, the converse does not hold. Because −∆EA−R

F does not

depend on the projective measurement {Pj} of the indirect measurement model (HM, ρM , U, {Pj}), there exist

many measurements whose entanglement gains are the same, but whose QC-mutual informations are different.

In fact, the following lemma shows that the entanglement gain is the upper limit of the QC-mutual information.

Lemma 1. For an arbitrary measurement {Ej}, the following inequality holds:

IQC ≤ −∆ESB−RF . (2.58)

The equality of the inequality (2.58) is achieved when we perform the “best” measurement on the memory.

Namely, there exists an indirect measurement model (HM, ρM , U, {Pj}) and a proper projective measurement

{P ′j} such that (HM, ρM , U, {Pj}) yields {Ej} and (HM, ρM , U, {P ′

j}) satisfies the equality of the inequality

(2.58).

The above lemma brings a very reasonable understanding of the information gain during the measurement

process. The information gain in the measurement process is finished before the end of the interaction between

the system and the memory. (Note that the entanglement gains of (HM, ρM , U, {Pj}) and (HM, ρM , U, {P ′j})

are the same.) However, in order to make the “fresh” information comprehensible to the classical observer,

we have to perform the projective measurement on the memory and obtain the classical outcome with the

probabilistic distribution. The entanglement gain expresses the amount of the fresh information, whereas the

QC-mutual information expresses the amount of the comprehended information.

Proof of Lemma 1: Let us take an arbitrary CP-instrument {Ej} and the indirect measurement model

(HM, |0M ⟩⟨0M |, U, {Pj}) which yields {Ej}. When we perform the CP-instrument {Ej} on S, the premeasure-

ment state ρ1 of SB becomes ρj2 := Ej(ρ1)/pj with the probability pj := tr[Ej(ρ)]. We take the reference system

R and the pure state |ψSBR⟩ of SBR such that trR[|ψSBR⟩⟨ψSBR|] = ρ1 We also define

ρSBR2 :=

∑j

Ej ⊗ 1R(|ψSBR⟩⟨ψSBR|) = trM [U(|ψSBR⟩ ⊗ |0M ⟩⟨ψSBR| ⊗ ⟨0M |)U†]. (2.59)

We first prove the inequality (2.58). Because of S(ρ1) = ESB−RF (|ψSBR⟩⟨ψSBR|) (2.17) and (2.53), the

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inequality (2.58) is equivalent to

ESB-RF (ρSBR

2 ) ≤∑

j

pjS(ρj2), (2.60)

Let prove (2.60). Let us define ρSBRj2 as follows;

ρSBRj2 :=

trM [PjU(|ψSBR⟩ ⊗ |0M ⟩⟨ψSBR| ⊗ ⟨0M |)U†Pj ]pj

. (2.61)

We also take the decomposition ρSBRj2 =

∑l q

jl |φ

jl ⟩⟨φ

jl | such that ESB−R

F (ρSBRj2 ) =

∑l q

jl E

SB−R(|φjl ⟩⟨φ

jl |).

Then, ρSBR2 =

∑j pjρ

SBRj2 =

∑j pj

∑l q

jl |φ

jl ⟩⟨φ

jl | holds, and thus

ESB−RF (ρSBR

2 ) ≤∑

j

pjEF (ρSBRj2 ) (2.62)

holds. Note that ρj2 =

∑l q

jl trR[|φj

l ⟩⟨φjl |] and that ESB−R(|φj

l ⟩⟨φjl |) = S(trR[|φj

l ⟩⟨φjl |]). Thus,

EF (ρSBRj2 ) =

∑l

qjl E

SB−R(|φjl ⟩⟨φ

jl |) =

∑l

qjl S(trR[|φj

l ⟩⟨φjl |]) ≤ S(

∑l

qjl trR[|φj

l ⟩⟨φjl |]) = S(ρj

2). (2.63)

holds. The inequalities (2.62) and (2.63) clearly yield (2.60).

Finally, we prove the achievability of the equality of (2.58). It is equivalent to that of (2.60). Let us

take the decomposition ρSBR2 =

∑m rm|Φm⟩⟨Φm| such that ESB−R

F (ρSBR2 ) =

∑m rmESB−R(|Φm⟩⟨Φm|) =∑

m rmS(ρm), where ρm := trR[|Φm⟩⟨Φm|]. Because of (2.59) and because U |ψSBR⟩⊗ |0M ⟩ is pure, there exists

a projective measurement {Pm} such that

PmU(|ψSBR⟩ ⊗ |0M ⟩|PmU(|ψSBR⟩ ⊗ |0M ⟩|

= |Φm⟩. (2.64)

Thus, (HM, |0M ⟩⟨0M |, U, {Pm}) clearly achieves the equality of (2.60). ¤

2.3.2 Second law of information thermodynamics with entanglement gain

Because of (2.16) and Lemma 1, the following inequality2 holds for an arbitrary thermodynamic operation with

feedback control which is introduced in the subsection 2.2.1;

Wfb ≤ −∆FS(β) − 1β

∆ESB−RF . (2.65)

The entanglement gain was given by pushing forward the idea of the QC-mutual information. The Sagawa-

Ueda inequality (2.16) means that the excess Wfb +∆F of the extracted work over the conventional second law

is bounded by the information gain IQC which is obtained by the measurement. However, the excess Wfb + ∆F

can be larger when the unitary interaction between the system and the memory is finished. The inequality

(2.65) expresses the bound of the excess at the end of the interaction between the system and the memory. At

the time, the excess Wfb + ∆F is bounded by the entanglement gain −∆ESB−RF regardless of the projective

measurement {Pj} on the memory and the feedback control {Uj}. From the above point of view, the inequality2In Ref. [28], the author treats not only one heat bath B, but also many heat baths {Bm}n

m=1. However, the essence can beseen in the case of n = 1, and thus we treat only the case of n = 1 for simplicity.

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(2.65) means that in the thermodynamic processes with feedback control, the extracted work can exceed the

conventional second law by the entanglement gain of the measurement.

The condition for the achievement of the upper bound of inequality (2.65) is looser than that of the inequality

(2.16). At first glance, this fact contradicts with (2.58). However, the contradiction is only spurious. Note that

when the entanglement gain is determined, we can take the projective measurement {P(j)} on the memory

freely; in other words, we can choose the “best” projective measurement. On the other hand, when the QC-

mutual information is determined, {Pj} is also determined already. Thus, the meanings of the achievability of

the equalities of (2.16) and (2.65) are different. The equality of (2.16) is achievable when there exists the proper

feedback {Uj} which satisfies the equality (2.16), whereas the equality of (2.65) is achievable when there exists

the proper projective measurement {Pj} and the proper feedback {Uj} which satisfies the equality (2.65).

Because of the achievability of the equality of (2.58), we can easily show the following corollary;

Corollary 1. If we can always achieve the upper bound of Eq. (2.16) with a proper feedback {U(k)}, we can

always achieve the upper bound of Eq. (2.65) with a proper set of projective measurement {P(k)} and feedback

{U(k)}.

However, the converse of the corollary is not true. When we use finite systems for the heat baths, there exists

the situation in which the equality of (2.65) is always achievable, but the equality of (2.16) is not achievable.

We give an example of the situation in Appendix A.

2.3.3 Energy costs of the information processes

Because the excess Wfb + ∆F of the extracted work over the conventional second law is bounded by the

entanglement gain, the energy cost of the information process should be written in the entanglement gain. In

fact, the lower bound of the energy cost for the measurement which are described by the entanglement gain is

tighter than (2.33). To be concrete, the following inequality holds;

WMmeas ≥ ∆FM

meas + kBT (−∆ES−RF − H{pk}) (2.66)

≥ ∆FMmeas + kBT (IQC − H{pk}). (2.67)

The equality of the inequality (2.67) is not achieved if the projective measurements on the memory are not

best. This fact means that the information thermodynamics is irreversible for the most measurement {Ek}; in

such cases, the sum of the energy costs for the measurement and the information erase is strictly larger than

the energy profit by the feedback control.

The inequality (2.66) can be shown in the same way as the proof of (2.33), by using the following lemma;

Lemma 2. For an arbitrary density matrix ρAA′ of systems A and A′, the following inequality holds;

S(ρA) ≤ EA−A′

F (ρAA′) + S(ρAA′), (2.68)

where ρA ≡ trA′ [ρAA′ ].

First, we prove (2.66) by using the above Lemma.

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Proof of (2.66): Because of (2.42), we only have to prove

∑k

pkS(ρMBM

k ) − S(ρG,β(HM0 + HBM )) ≥ −∆ES−R

F − H{pk}. (2.69)

In order to prove (2.69), we introduce the reference system R to have a pure state |ψ⟩ of the composit system

SMBMR, which satisfies trR[|ψ⟩⟨ψ|] = ρmi . By the unitary interaction USMBM , the pure state |ψ⟩ becomes

|ψ′⟩ := USMBM ⊗ 1R|ψ⟩. By definition, |ψ′⟩ satisfies trR[|ψ′⟩⟨ψ′|] = ρm1 .

By applying Lemma 2 to the mixed state ρ′SR := trMBM[|ψ′⟩⟨ψ′|] of SR, we obtain

S(trSMBM [|ψ′⟩⟨ψ′|]) ≤ ES−RF (ρ′SR) + S(ρ′SR). (2.70)

Because of trSMBM[|ψ′⟩⟨ψ′|] = trSMBM

[|ψ⟩⟨ψ|], the inequality (2.70) is equivalent to

S(trSMBM[|ψ⟩⟨ψ|]) ≤ ES−R

F (ρ′SR) + S(ρ′SR). (2.71)

Because of S(trSMBM[|ψ⟩⟨ψ|]) = S(trR[|ψ⟩⟨ψ|]), ρm

i = trR[|ψ⟩⟨ψ|], (2.28) and (2.53), the inequality (2.71) is

equivalent to

−∆ES−RF ≤ S(ρ′SR) − S(ρG,β(HM

0 + HBM )). (2.72)

Thus, we only have to prove

S(ρ′SR) ≤ H{pk} +∑

k

pkS(ρMBM

k ). (2.73)

We derive (2.73) as follows

S(ρ′SR)(a)= S(trSR[|ψ′⟩⟨ψ′|]) (2.74)(b)

≤ S(∑

k

trSR[Pk|ψ′⟩⟨ψ′|Pk]) (2.75)

(c)= S(

∑k

pkρMBM

k ) (2.76)

(d)

≤ H{pk} +∑

k

pkS(ρMBM

k ) (2.77)

where the equality (a) follows from trMBM[|ψ′⟩⟨ψ′|] = ρ′SR, the inequality (b) follows from the general formula

S(ρ) ≤ S(∑

l PlρPl), the equality (c) follows from the definition of ρMBM

k , , and the inequality (d) follows from

the general formula S(∑

l qlρl) ≤ H{ql} +∑

l qlS(ρl). ¤Finally, we prove Lemma 2.

Proof of Lemma 2: Let us refer to the optimal ensemble of ρAA′ as {rm,∣∣∣ψAA′

m

⟩}; in other words,

EA−A′

F (ρAA′) =∑

m rmEA−A′(∣∣∣ψAA′

m

⟩) holds. We also refer to trA′ [

∣∣∣ψAA′

m

⟩⟨ψAA′

m

∣∣∣] as ρAm. Note that (2.68) is

equivalent to

S(∑m

rmρAm) ≤

∑m

rmS(ρAm) + S(

∑m

rm

∣∣∣ψAA′

m

⟩⟨ψAA′

m

∣∣∣). (2.78)

After straightforward algebra, we can reduce (2.78) into

∑m

rmD(ρAm||ρA) ≤

∑m

rmD(∣∣∣ψAA′

m

⟩⟨ψAA′

m

∣∣∣ ||ρAA′). (2.79)

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Because the relative entropy decreases after partial trace, the inequality (2.79) holds clearly. We have thereby

completed the proof of Lemma 2. ¤

2.4 Achievability of the equality of the principle of maximal work

In the sections 2.1, 2.2 and 2.3, we derived several thermodynamical inequalities. However, there was neither

a proof or a counterproof that the equalities of the inequalities are generally achievable. Tasaki’s derivation

of (2.4) does not tell us whether there exists a unitary U on SB which achieves the equality of (2.4). Under

the assumption that there exists a unitary U on SB which achieves the equality of (2.4), Sagawa and Ueda

give an example of the information isothermal process which achieves the equality of (2.16). Under the same

assumption, Jacobs proved the achievability of the equality of (2.16) more generally [26]. However, these proofs

assume that there exists a unitary on SB which achieves the equality of (2.4).

In 2014, Skrzypczyk, Short, and Popescu constructed a concrete setup of the fully quantum work extraction,

and shown the second law and the achievability of the equality of the inequality Wext ≤ −∆F [12]. In the

present section, we review their results in Ref. [12].

2.4.1 Setup and the thermodynamical quantities

We consider the total system as a composit system of a thermodynamic system S, a heat bath B with inverse

temperature β, and a work storage W . The system S is an arbitrary finite-dimensional system with an arbitrary

Hamiltonian HS . We define the thermodynamic quantities of the system S which is in the state ρ as follows;

the internal energy U(ρ) := Tr[ρHS ], the entropy S(ρ) := −Tr[ρ log ρ], and the Helmholtz free energy F (ρ) :=

U − 1β S. Note that the definition of the free energy in the present section is different from that of the sections

2.1, 2.2 and 2.3; in the present section, the Helmholtz free energy is a function of the state ρ. We take an

arbitrary fixed state ρS as the initial state of the system S. We consider the heat bath B as an unlimited

source of supply of finite-dimensional systems {Bm}∞m=1 with arbitrary Hamiltonians {HBm}∞m=1. The initial

states ρBmof Bm are given by Gibbs states τBm

:= exp(−βHBm)/Z(β,HBm

). When, the thermodynamical

process turns the states of Bm into σBm , we define the absorbed heat Q :=∑

m Tr[HBm(τBm − σBm)]. The

work storage W is a suspended weight with the Hamiltonian HW = mgx, where x is the position operator. We

define the extracted work Wext as the average energy gain of W ; if the initial and the final state are ρW and

σW , the extracted work is expressed as Wext = Tr[HW (σW − ρW )]. We also define a translation operator Γa,

which translates the position of the weight as Γa|x⟩ = |x + a⟩, where |x⟩ and |x + a⟩ are the eigenstates of x

whose eigenvalues are x and x + a.

2.4.2 Isothermal operation

Under the above setup, we consider a unitary transformation U of the composit system SBW as an isothermal

operation. We request the following three constraints of U .

・ The unitary transformation U conserves the average energy of SBW for the fixed initial states of S and B

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but for an arbitrary initial state of W . Namely, the following equality holds;

Tr[(HS +∑m

HBm + HW )(ρS ⊗ (⊗mτBm)⊗ ρW )] = Tr[(HS +∑m

HBm + HW )U(ρS ⊗ (⊗mτBm)⊗ ρW )U†]

(2.80)

・ The dynamics of the composit system SB does not depend on the initial state of W . Namely, the following

equality holds for arbitrary ρW and ρ′W ;

TrW [U(ρS ⊗ (⊗mτBm) ⊗ ρW )U†] = TrW [U(ρS ⊗ (⊗mτBm) ⊗ ρ′W )U†] (2.81)

・ The unitary U commutes with the translation operator Γa for an arbitrary real number a.

Because of the second constraint, the dynamics of SB must be unital, namely,

TrW [U(1SB ⊗ ρW )U†] = 1SB (2.82)

holds. (Proof : Because of the second constraint,

TrW [U(1SB ⊗ ρW )U†] = TrW [U(1SB ⊗ 1SB)U†] (2.83)

holds. The right-hand side of (2.83) is clearly equal to 1SB . ¤)

We refer to the final states of S, B and W as σS , σB and σW , where

σS := TrBW [U(ρS ⊗ (⊗mτBm) ⊗ ρW )U†] (2.84)

σB := TrSW [U(ρS ⊗ (⊗mτBm) ⊗ ρW )U†] (2.85)

σW := TrSB [U(ρS ⊗ (⊗mτBm) ⊗ ρW )U†] (2.86)

2.4.3 The second law

Let us prove that we cannot obtain a positive quantity of Wext without changing the state of the system S;

ρS = σS3 In the present subsection, we prove the second law by the different way from Ref. [12], as our proof is

simpler. Because of ρS = σS and because the unitary U conserves the total energy, we have to make Q positive

in order to make Wext positive; namely, we have to take an isothermal process which decreases the average

energy of B. Because the Gibbs state is the maximal-entropy state with given average energy, an isothermal

process which decreases the average energy of B also decreases the entropy of B. Thus, if we could obtain a

positive quantity of Wext without changing the state of the system S, there would exist an isothermal process

which satisfies S(σB) − S(ρB) =: ∆SB < 0 and ρS = σS .

Let us prove the above isothermal process does not exist. Because the dynamics of SB is unital, ∆SSB ≥ 0

holds. Because the von Neumann entropy is subadditive and because of ρS = σS , the inequlaity ∆SSB ≥ 0

reduces to ∆SB ≥ 0. ¤

2.4.4 The achievability of the equality of the principle of maximal work

Finally, we construct an N -step isothermal process which changes the state of S from ρS =∑

n pn|ψn⟩⟨ψn| to

σS =∑

n p′n|ψ′n⟩⟨ψ′

n| and satisfies Wext = F (ρS) − F (σS) − O(1/N). We construct each step of the process as

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a combination of a unitary transformation V1 on SW and a unitary construction V2 on SBW . The unitary V1

is given as

V1 :=∑

n

|En⟩⟨ψn| ⊗ Γϵn , (2.87)

where {|En⟩} are the energy eigenstates of the system S, and where ϵn := ⟨ψn|HS |ψn⟩ − En. Note that the

unitary V1 conserves the entropy of S, the entropy of SW and the average of energy of SW . Thus, V1 satisfies

Wext = F (ρS) − F (ρ′S), where ρ′S := TrBW [V1(ρS ⊗ (⊗mτBm) ⊗ ρW )V †1 ].

The unitary V2 turns the state∑

n pn|En⟩⟨En| into∑

n qn|En⟩⟨En|. For simplicity, we treat only the case

in which q0 = p0 − δp, q1 = p1 + δp and qn = pn for n ≥ 2, as an example. As the initial state of a qubit Bm

for the transformation V2, we take the Hamiltonian of HBm whose Gibbs state satisfies

τBm =q0

q0 + q1|0⟩⟨0| + q1

q0 + q1|1⟩⟨1|. (2.88)

We define the unitary V2 as follows:

V2|E0⟩S |1⟩Bm |x⟩W := |E1⟩S |0⟩Bm |x + ϵ⟩W , (2.89)

where ϵ := EBm − E1 + E0 and EBm is the difference of eigenvalues of HBm . The extracted work Wext in V2

is equal to ϵδp. The change of the inner energy of S is equal to δU = δp(E1 − E0). The change of the entropy

of S is equal to δSS = δpβEBm + O(δp2). Thus the change of the free energy is approximately equal to the

extracted work; Wext = δF + O(δp).

Now, we can construct the isothermal process which changes the state of S from ρS to σS and satisfies

Wext = F (ρS) − F (σS) − O(1/N). The unitary V1 turns ρS into∑

n pn|En⟩⟨En|. We can turn∑

n pn|En⟩⟨En|into

∑n p′n|En⟩⟨En| by using V2 repetedly. Finally, the unitary V ′†

1 turns∑

n p′n|En⟩⟨En| into∑

n p′n|ψ′n⟩⟨ψ′

n|,where we obtain V ′

1 substituting |ψ′n⟩ for |ψn⟩ of V1. Note that V1, V2 and V ′†

1 satisfy Wext = F (ρS) − F (σS)

approximately. The isothermal process which consists of V1, V2 and V ′†1 satisfies Wext = F (ρS)−F (σS)−O(1/N).

¤

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Chapter 3

Work Extraction as a Measurement

Process

3.1 A Contradiction between Two Scenarios for Work Extraction

As we reviewed in Chapter 2, there exist two well-known scenarios for the work extraction from quantum

systems:

Semi-classical scenario [8–10, 25–30]: In this scenario, the classical external operator performs the unitary

time evolution UI := T→ exp(∫−iHI(t)dt) on I by time-dependently controlling the control parameter

of the Hamiltonian HI(t) of the internal system I (which usually consists of the system S and the heat

bath B). During the time evolution, the energy is transmitted from the internal sytem to the external

controller through the back reaction of the control parameter, and we regard the energy loss as the

extracted work [8, Section 2].

Fully quantum scenario [11, 12, 31, 33–37] In this scenario, we consider not only the internal system I but

also the external system EX , whose Hilbert spaces are HI and HEX , respectively. We perform an arbitrary

unitary transformation UIEXon the total system IEX which conserves the energy of the total system

IEX , and regard the energy gain of EX as the extracted work.

Both of the above two scenarios are persuasive. However, there exists a contradiction between them. For

an arbitrary unitary transformation UIEX and an arbitrary fixed initial state ρEX of the external system EX ,

the true time evolution of the internal system I is given by

ΛI(ρI) = TrEX[UIEX ρI ⊗ ρEX U†

IEX], (3.1)

where ρI is an arbitrary initial state of the internal system. According to the semi-classical senario, the time

evolution of the internal sytsem is the unitary UI . In order to ΛI(ρI) = UIρIU†I , the unitary UIEX

should be

written as UI ⊗ VEX , where VEX is a unitary transformation on EX . However, such a unitary does not cause

the energy transfer between I and EX , because UI ⊗ VEX means that I and EX are detached.

The usual explanation for this contradiction is as follows: the unitary UI is just an approximation of the

true time evolution of I; namely, UIρIU†I ≈ ΛI(ρI) for an arbitrary state ρI . If EX is large enough, there might

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be a special Hamiltonian HEXof EX , a special initial state ρEX

of EX and a special unitary operation VIEX

on IEX such that the total energy is conserved and UIρIU†I ≈ ΛI(ρI) is satisfied at the same time. If the set

{VIEX , ρEX ,HEX} exists, we can regard the energy loss of I as the extracted work, because the energy loss of

I is equal to the energy gain of EX for an arbitrary initial state of I.

The above explanation sounds persuasive. However, we pose two questions still exist about the explanation;

Question 1: Does the set {VIEX, ρEX

,HEX} really exist?

Question 2: Can we know the amount of the extracted work from observing EX?

The answer to Question 1 is Yes. In the next subsection 3.1.1, we give an example of the set {VIEX, ρEX

,HEX}.

However, the answer to Question 2 is No. We will show in Subsection 3.1.2 that, whenever ΛI is approximately a

unitary transformation, we can know practically nothing about the amount of the extracted work from observing

EX . Note that in the classical work extraction, the answer to Question 2 is clearly Yes. For example, we can

know the amount of the extracted work by seeing the change in the position of a suspended weight. In the

quantum work extraction, the situation is quite different. In Subsection 3.1.2, we will show a trade-off inequality,

which tells us that in order to know the amount of the extracted energy, we have to destroy the coherence of

the internal system; namely, the work extraction must be a measurement.

3.1.1 The answer to Question 1: an example of the set {VIEX, ρEX

, HEX}

Let us give an example of the set {VIEX , ρEX ,HEX} which satisfies

[VIEX,HI + HEX

] = 0, (3.2)

ΛI(ρI) ≈ UIρIU†I , for any ρI . (3.3)

In order to make (3.3) more specific mathematically, we define the degree of approximation ϵ between ΛI and

the unitary transformation UI on HI as follows:

b(ΛI(ρ), UIρU†I ) ≤ ϵ for any ρ, (3.4)

where b is the Bures distance b(ρ, σ) :=√

1 − F (ρ, σ) with F being the fidelity F (ρ, σ) := Tr[√√

σρ√

σ].

For simplicity, let us consider an example of {VIEX, ρEX

,HEX}

HI =D∑

j=1

j|j⟩I⟨j|I , (3.5)

where D is the dimensionality of HI . (We can treat the more general examples in the same way.) For an

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arbitrary unitary transformation UI :=∑

k,l ukl|k⟩I⟨l|I , we can take the set {VIEX, ρEX

,HEX} as follows:

VIEX |k⟩I |m⟩EX :=D∑

l=1

ukl|l⟩I |m + k − l⟩EX (3.6)

ρEX= |ψ⟩⟨ψ| with |ψ⟩ :=

4D⌈1/ϵ2⌉∑m=1

1√4D⌈1/ϵ2⌉

|m⟩, (3.7)

HEX:=

∞∑k=−∞

k|k⟩EX⟨k|, (3.8)

where ⌈x⌉ is the ceiling function of x.

Proof:Because the unitary VIEXturns the energy pure eigenstate |k⟩I |m⟩EX

of HI + HEXinto another

energy pure eigenstate of HI + HEX whose eigenvalue is k + m for arbitrary k and m, the unitary VIEX clearly

satisfies (3.2). Thus, we only have to show that the set {VIEX , ρEX ,HEX} satisfies (3.4) for an arbitrary pure

state |φI⟩ :=∑D

i=1 ai |i⟩I of the internal system. By writing |ψ⟩ as∑∞

k=−∞ Ck|k⟩, we obtain

VIEX|φ⟩I |ψ⟩ = VIEX

D∑i=1

∞∑k=−∞

aiCk |i⟩I |k⟩EX(3.9)

=∑

i

∑j

∑k

uijaiCk |j⟩I |k + i − j⟩EX(3.10)

=∑

i

∑j

∑k

uijaiCk−i+j |j⟩I |k⟩EX. (3.11)

In order to derive b(ΛI(|φ⟩I⟨φ|I), UI |φ⟩I⟨φ|IU†I ) < ϵ , we derive an inequality about F (ΛI(|φ⟩I⟨φ|I), UI |φ⟩I⟨φ|IU†

I ).

Because of (3.11), we obtain

F (ΛI(|φ⟩I⟨φ|I), UI |φ⟩I⟨φ|IU†I ) = ⟨φ|IU†

I ΛI(|φ⟩I⟨φ|I)UI |φ⟩I (3.12)

=∑

k

⟨φ|I⟨k|EX U†I (VIEX |φ⟩I |ψ⟩⟨φ|I⟨ψ|V †

IEX)UI |φ⟩I |k⟩EX (3.13)

=∑

i,i′,i′′,i′′′,j,j′,k

u∗i′′′,jui′′,jai′′a

∗i′′′Ck−i′′+j′Ck−i+j (3.14)

Because of the definition of |ψ⟩, the equalities Ck = Ck−i+j = 1/√

4D⌈1/ϵ2⌉ hold for the range D + 1 ≤ k ≤

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D(4⌈1/ϵ2⌉ − 1). Thus, we obtain

∑i,i′,i′′,i′′′,j,j′,k

u∗i′′′,jui′′,jai′′a

∗i′′′Ck−i′′+j′Ck−i+j

=D(4⌈1/ϵ2⌉−1)∑

k=D+1

∑i,i′,i′′,i′′′,j,j′

u∗i′′′,jui′′,jai′′a

∗i′′′Ck−i′′+j′Ck−i+j +

∑other k

∑i,i′,i′′,i′′′,j,j′

u∗i′′′,jui′′,jai′′a

∗i′′′Ck−i′′+j′Ck−i+j

=D(4⌈1/ϵ2⌉−1)∑

k=D+1

∑i,i′,i′′,i′′′,j,j′

u∗i′′′,jui′′,jai′′a

∗i′′′

14D⌈1/ϵ2⌉

+∑

other k

∑i,i′,i′′,i′′′,j,j′

u∗i′′′,jui′′,jai′′a

∗i′′′Ck−i′′+j′Ck−i+j

=∑

i,i′,i′′,i′′′,j,j′

u∗i′′′,jui′′,jai′′a

∗i′′′

D(4⌈1/ϵ2⌉ − 2)4D⌈1/ϵ2⌉

+∑

other k

∑i,i′,i′′,i′′′,j,j′

u∗i′′′,jui′′,jai′′a

∗i′′′Ck−i′′+j′Ck−i+j

=D(4⌈1/ϵ2⌉ − 2)

4D⌈1/ϵ2⌉−

∣∣∣∣∣∣∑

other k

∑i,i′,i′′,i′′′,j,j′

u∗i′′′,jui′′,jai′′a

∗i′′′Ck−i′′+j′Ck−i+j

∣∣∣∣∣∣≥ D(4⌈1/ϵ2⌉ − 2)

4D⌈1/ϵ2⌉− 2D

4D⌈1/ϵ2⌉=

⌈1/ϵ2⌉ − 1⌈1/ϵ2⌉

≥ 1 − ϵ2 (3.15)

Namely, we obtain

F (ΛI(|φ⟩I⟨φ|I), UI |φ⟩I⟨φ|IU†I ) ≥ 1 − ϵ2. (3.16)

By substituting the left-hand side of (3.16) for the definition of the Bures distance, we obtain

b(ΛI(|φ⟩I⟨φ|I), UI |φ⟩I⟨φ|IU†I ) ≤

√1 −

√1 − ϵ2 ≤ ϵ (3.17)

Therefore, (3.4) is satisfied. ¤

The above example gives not only the answer to Question 1, but also a good insight into Question 2. Note

that the state |ψ⟩EX is very broad in the energy space. If we take an initial state of EX whose support is

narrow in the energy space, the inequality (3.4) does not hold. However, the states which are broad in the

energy space, changes little under the unitary VIEXfor an arbitrary initial state of I. This fact leads us to

the following anticipation; whenever the unitary UIEX satisfies (3.3), the final state of EX is hardly affected

by the initial state of I. In the next subsection 3.1.2, we will show that the anticipation is right, by applying

the knowledge about the relationship between the information gain and the coherence destruction to the work

extraction.

3.1.2 The answer to Question 2: the trade-off relation

Theorem 1. When the unitary transformation UIEXand the initial state ρEX

satisfy

b(ΛI(ρ), UIρU†I ) ≤ ϵ for any ρ (3.18)

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for a unitary UI , then the following inequality holds for arbitrary states ρ and ρ′ on HI4 :

b(σρEX

, σρ′

EX) ≤ 4

√ϵ, (3.19)

where σρEX

:= TrI [UIEXρ ⊗ ρEX

U†IEX

].

Proof:The Bures distance satisfies the following properties [58]:

b(ρ1, ρ3) ≤ b(ρ1, ρ2) + b(ρ2, ρ3), (3.20)

b(ρ, ρ′) = b(UρU†, Uρ′U†), (3.21)

b(ρ, ρ′) ≥ b(κ(ρ), κ(ρ′)), (3.22)

b2(ρ ⊗ σ, ρ′ ⊗ σ′) = b2(ρ, ρ′) + b2(σ, σ′) − b2(ρ, ρ′)b2(σ, σ′), (3.23)

b(ρ + ρ′

2, ρ′

)≤

√1 − 1√

2, (3.24)

where κ is an arbitrary CP-TP map.

We carry out the proof (3.19) in cases of b(ρI , ρ′I) ≤ 2ϵ, 2ϵ ≤ b(ρI , ρ

′I) ≤

√1 −

√1/2, and

√1 −

√1/2 ≤

b(ρI , ρ′I) ≤ 1. In the case of b(ρI , ρ

′I) ≤ 2ϵ, we can derive (3.19) as follows:

4√

ϵ ≥ 2ϵ ≥ b(ρI , ρ′I)

(a)= b(ρI ⊗ ρEX , ρ′I ⊗ ρEX )

(b)= b(σρI

IEX, σ

ρ′I

IEX)

(c)

≥ b(σρI

EX, σ

ρ′I

EX). (3.25)

where (a) follows from (3.23), (b) follows from (3.21), and (c) follows from (3.22) whose κ is the partial trace of

I.

Next, we prove (3.19) in the case of 2ϵ ≤ b(ρI , ρ′I) ≤

√1 −

√1/2. Because of (3.18), (3.20) and (3.21), we

obtain

b(ΛI(ρI), ΛI(ρ′I)) ≥ b(UIρIU†I , UIρ

′IU

†I ) − b(ΛI(ρI), UIρIU

†I ) − b(ΛI(ρ′I), UIρ

′IU

†I ) (3.26)

≥ b(ρI , ρ′I) − 2ϵ. (3.27)

From (3.22) and (3.23), we also obtain

b(σρI

IEX, σ

ρ′I

IEX) ≥ b(ΛI(ρI) ⊗ σρI

EX, ΛI(ρ′I) ⊗ σ

ρ′I

EX)

=√

b2(ΛI(ρI), ΛI(ρ′I)) + b2(σρI

EX, σ

ρ′I

EX) − b2(ΛI(ρI),ΛI(ρ′I))b2(σρI

EX, σ

ρ′I

EX). (3.28)

Moreover, because of (3.21) and (3.23),

b(σρI

IEX, σ

ρ′I

IEX) = b(ρI ⊗ ρEX

, ρ′I ⊗ ρEX) = b(ρI , ρ

′I) (3.29)

4Here, we use the Bures distance in order to define the approximation degree between the time evolution ΛI of I and the unitarytransformation UI . As in Refs. [48] and [49], we can give a similar trade-off relation between the information gain of EX and thedisturbance of I, which is defined with using the coherent information. We use the Bures distance because the Bures distanceenables us to make the scope of application of Theorem 1 larger than the coherent information. For example, we can construct theset of a special initial state ρEX

of EX and a unitary interaction UIEXon IEX which satisfies (3.18) for an arbitrary ρI , but the

disturbance of the internal system is large for a specific ρspecI .

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holds. Thus, substituting (3.27) and (3.29) for (3.28), we obtain

4ϵb(ρI , ρ

′I) − ϵ

1 − (b(ρI , ρ′I) − 2ϵ)2≥ b2(σρI

EX, σ

ρ′I

EX). (3.30)

Note that

1 ≥ b(ρI , ρ′I) − ϵ

1 − (b(ρI , ρ′I) − 2ϵ)2

holds for the case of 2ϵ ≤ b(ρI , ρ′I) ≤

√1 −

√1/2. Therefore, (3.19) holds for the case of 2ϵ ≤ b(ρI , ρ

′I) ≤√

1 −√

1/2.

Finally, we prove (3.19) in the case of√

1 −√

1/2 ≤ b(ρI , ρ′I) ≤ 1. Note that b(ρI ,

ρI+ρ′I

2 ) ≤√

1 −√

1/2

and b(ρ′I ,ρI+ρ′

I

2 ) ≤√

1 −√

1/2 hold for arbitrary ρI and ρ′I . Therefore, we obtain

b(σρI+ρ′

I2

EX, σ

ρ′I

EX) ≤ 2

√ϵ, (3.31)

b(σρI+ρ′

I2

EX, σρI

EX) ≤ 2

√ϵ. (3.32)

Hence, we obtain (3.19) from (3.20):

b(σρI

EX, σ

ρ′I

EX) ≤ 2

√ϵ + 2

√ϵ = 4

√ϵ. (3.33)

¤

The inequality (3.19) implies that if we perform an approximate unitary time evolution on I, we cannot know

the amount of the energy gain of EX by observing EX . The Bures distance b(ρ, σ) is equal to the maximum of

the Helinger distance bc({pm}, {qm}) [58]:

b(ρ, σ) = max{Em}:POVM

bc({pm}, {qm}), (3.34)

where pm := Tr[ρEm] and qm := Tr[σEm]. That is, the Bures distance b(ρ, σ) expresses the limit of the

distinguishability between ρ and σ under the POVM measurements. Thus, if we perform an approximate

unitary time evolution on I, the observation on EX cannot distinguish the final states of EX even though I

starts from different initial states. This fact also implies that the energy transfer from I to EX is the heat rather

than the work when the time evolution of I is approximately unitary, because we have to guess the amount

of the energy transfer from observing I. Thus, the unitary semi-classical scenario is inappropriate as the work

extraction scenario.

In order to avoid the above problem, we have to take a large value of ϵ. This fact shows that in order to

know the amount of the extracted energy, we have to destroy the coherence of I; namely, a work extraction

must be a measurement.

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3.2 Work extraction as a measurement process

Based on the previous section, let us formulate the work extraction as a measurement process in the present

section. Here, we show a rough sketch of the formulation. As the previous section, we consider the total system

IEX which consists of the internal system I and the external system EX . The internal system I consists of

the system S and the heat baths {Bm}, and the external system EX contains the work storage W . When we

consider the work extraction with feedback control EX consists of the work storage W and the memory system

M . When we consider the work extraction with feedback control EX is just the work storage W . We perform

a unitary transformation on IEX which conserves the total energy of IEX . After the unitary transformation,

we perform a measurement on EX . We define the work extraction as the energy transfer from I to EX during

the above process, which satisfies the following conditions:

Condition 1 We can know the amount of the amount of the energy loss of I from the outcome of the mea-

surement on EX .

Condition 2 The entropy of the work storage W does not increase during the unitary transformation on IEX .

Note that the time evolution of the internal system is a measurement process. In the present section, we show

the detail of the above rough sketch.

3.2.1 CP-work extraction

We firstly focus on the time evolution of the internal system I of the work extraction in the present subsection.

As the minimal requirement, we demand that the time evolution is a measurement on I such that the average

of the measured values of the measurement is equal to the average energy loss of I during the measurement;

Definition 1 (CP-work extraction). Let us take an arbitrary set of a CP-instrument {Ej}j∈J and measured

values {wj}j∈J , where each Ej is a completely positive map, and where∑

j Ej is a completely positive and

trace preserving (CPTP) map, and where J is the set of the outcome, which can be either a discrete set or a

continuous set. When the set {Ej , wj}j∈J satisfy the following equality for any state ρ on HI , we refer to the

set {Ej , wj}j∈J as the CP-work extraction:

TrHIρ =∑

j

wjTrEj(ρ) +∑

j

TrHIEj(ρ), (3.35)

where HI is the Hamiltonian of I.

There are two important points in the above definition. First, we does not any request for what {Ej}measures. Thus, {Ej} might not be the measurement about energy. For example, we can measure some

particle’s track as {Ej}. In that case, {wj} is given as a function of the track, and we can take an arbitrary

function {wj} which satisfies (3.35).

Second, whereas HI does not change during the CP-work extraction, we can treat by the method in Ref. [33]

the case in which the Hamiltonians of the working body and the heat baths changes do. To do so, we divide

the internal system I into two subsystems I1 and I2. The first part I1 consists of the working body and the

heat baths, while the second part I2 controls the Hamiltonian of I1. Let the total Hamiltonian of I be

HI =∑

λ

Hλ ⊗ |λ⟩⟨λ|, (3.36)

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where Hλ is the Hamiltonian of I1 and where {|λ⟩} is a orthonomal basis of I2. The CP-work extraction on

I in which the state of I changes from ρI1 ⊗ |λini⟩⟨λini| to σI1 ⊗ |λfin⟩⟨λfin| corresponds to the thermodynamic

operation of I1 in which the Hamiltonian and the state of I1 change from (Hλini , ρI1) to (Hλfin , σI1).

Now we have formulated of the work extraction for the internal system with the minimal request. However, it

is too general for practical purpose. More specifically, the average∑

j wjTrEj(ρ) is the averaged extracted work,

but each value wj may not be the extracted work in the case that the measurement outcome is j. Moreover,

the CP-work extraction includes both of the work extractions with and without feedback control. Thus, we

give two classes of the practical work extractions. The first class is called as the CP-strong work extraction, in

which each value wj means that the amount of the extracted work from I in the case that the measurement

outcome is j.

Definition 2 (CP-strong work extraction). Let us take an arbitrary set of a CP-instrument {Ej}j∈J and

measured values {wj}j∈J . Let |x⟩ ∈ HI be an arbitrary normalized eigenvector of HI with an eigenvalue hx.

We denote the spectral decomposition of HI as HI =∑

h hPh, where Ph is the projection to the energy eigenspace

of HI whose eigenvalue is h. When the following equality holds for each j, we refer to the set {Ej , wj}j∈J as

the CP-strong work extraction.

PhEj(|x⟩⟨x|)Ph

= Ej(|x⟩⟨x|) (h = hx − wj),

= 0 (otherwise).(3.37)

The equations (3.37) means that if the initial state of the internal system I has the energy of a definitive

value, then the internal system also has the energy of a definitive value, after j is determined, and the value

wj expresses the difference of energy between initial and final. Thus, when the initial state ρI of I is the

diagonalized by {PI|y}, the value wj is equal to the average energy loss of I in the case the the measurement

outcome is j. In this sense, each value wj expresses the amount of the extracted work. As we show at the end

of the present subsection, the CP-strong work extraction is the special case of the CP-work extraction.

Lemma 3. When a set of {Ej , wj}j∈J is a CP-strong work extraction, it is also a CP-work extraction.

The second class is called as the CP-unital work extraction, which corresponds to the work extraction

without feedback control.

Definition 3 (CP-unital work extraction). Let us take a CP-work extraction {Ej , wj}j∈J . When the CPTP-

map∑

j Ej is unital, namely the equation∑

j Ej(1I) = 1I holds, we refer to the CP-work extraction {Ej , wj}j∈J

as the CP-unital work extraction.

Let us show that the work extraction without feedback control must be the CP-unital work extraction.

Let the initial states of I and EX be ρI and ρEX . We perform a unitary transformation UIEX on IEX , and

perform a measurement {Mk} on EX . After the unitary transformation UIEX , the states of I and EX become∑j Ej(ρI) = TrEX

[UIEX(ρI ⊗ ρEX

)U†IEX

] and Λ(σEX) := TrI [UIEX

(ρI ⊗ ρEX)U†

IEX] In the case of the work

extraction without feedback, the external system EX is just the work storage W . Thus, during the unitary

UIEX , the entropy of the external system EX does not increase;S(Λ(ρEX )) = S(ρEX ). Because the unitary

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transformation conserves the entropy, and because of the subadditibity of the entropy, we obtain

S(ρI) + S(ρEX ) = S(ρI ⊗ ρEX ) = S(UIEX ρI ⊗ ρEX U†IEX

) ≤ S(Λ(ρEX )) + S(∑

j

Ej(ρI)). (3.38)

S(ρI) ≤ S(∑

j

Ej(ρI)). (3.39)

Because a unital CPTP-map conserves or increases the von Neumann entropy [61], the CP-unital work extraction

satisfies (3.39). Because (3.39) holds for an arbitrary ρI ,

S(1/d) ≤ S(∑

j

Ej(1/d)) (3.40)

holds, where d is the dimension of the internal system I. Because S(ρ) < S(1/d) holds for arbitrary ρ = 1/d,

when (3.39) holds,∑

j Ej(1/d) = 1/d also holds. Thus, the time evolution of the internal system of the work

extraction without feedback control must be unital.

Proof of Lemma 3: We only have to prove that {Ej , wj}j∈J satisfies (3.35). We denote the special

decomposition of HI as HI =∑

h hPh, where Ph is the projection to the energy eigenspace of HI whose

eigenvalue is h. Let {|x⟩} be the energy eigenbasis of HI , and {Mj,k} be a set of operation elements for {Ej};namely,

Ej(ρ) =∑

k

Mj,kρM†j,k (3.41)

holds for an arbitrary state ρ. Because of (3.37), the following equality holds for the matrix elements mx′,xj,k :=

⟨x′|Mj,k|x⟩;mx′,x

j,k = mx′,xj,k δhx−hx′ ,wj (3.42)

where hx and hx′ is the energy eigenvalues of |x⟩ and |x′⟩. From (3.41), (3.42) and∑

j,k M†j,kMj,k = 1I , we

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obtain (3.35) as follows;

∑j

Tr[HIEj(ρ)] =∑

j

∑y

⟨y|HIEj(ρ)|y⟩ (3.43)

(a)=

∑j,k

∑y

⟨y|HIMj,kρM†j,m|y⟩ (3.44)

=∑j,k

∑y

hy⟨y|Mj,kρM†j,k|y⟩ (3.45)

=∑j,k

∑y

∑x,x′

hymy,xj,k rx,x′(my,x′

j,k )∗ (3.46)

(b)=

∑j,k

∑y

∑x,x′

hymy,xj,k rx,x′(my,x′

j,k )∗δhx−hy,wj δhx′−hy,wj (3.47)

=∑j,k

∑y

∑x,x′

(hx − wj)my,xj,k rx,x′(my,x′

j,k )∗δhx,hx′ (3.48)

=∑j,k

∑y

∑x,x′

hxmy,xj,k rx,x′(my,x′

j,k )∗δhx,hx′ −∑j,k

∑y

∑x,x′

wjmy,xj,k rx,x′(my,x′

j,k )∗δhx,hx′(3.49)

(c)=

∑x,x′

hxrx,x′δx,x′δhx,hx′ −∑j,k

∑y

∑x,x′

wjmy,xj,k rx,x′(my,x′

j,k )∗δhx,hx′ (3.50)

= Tr[HIρ] −∑j,k

∑y

∑x,x′

wjmy,xj,k rx,x′(my,x′

j,k )∗δhx,hx′ (3.51)

(d)= Tr[HIρ] −

∑j,k

∑y

∑x,x′

wjmy,xj,k rx,x′(my,x′

j,k )∗δhx,hx′ δhx−hy,wj δhx′−hy,wj (3.52)

= Tr[HIρ] −∑j,k

∑y

∑x,x′

wjmy,xj,k rx,x′(my,x′

j,k )∗δhx−hy,wj δhx′−hy,wj (3.53)

(e)= Tr[HIρ] −

∑j,k

∑y

∑x,x′

wjmy,xj,k rx,x′(my,x′

j,k )∗ (3.54)

= Tr[HIρ] −∑

j

wjTr[Ej(ρ)] (3.55)

where the equality (a) follows from (3.41), the matrix elements rx,x′ are defined as rx,x′ := ⟨x|ρ|x′⟩, the equality

(b) follows from (3.42), the equality (c) follows from∑

j,k M†j,kMj,k = 1I , and the equalities (d) and (e) follow

from (3.42). ¤In the present subsection, we have defined the CP-work extraction as the measurement such that

∑j pjwj

means the average work. We also have defined two classes of the CP-work extraction for practical use. The first

one is the CP-strong work extraction, in which each value wj means the extracted work in the case that the

measurement outcome is j. The second one is the CP-unital work extraction, which corresponds to the work

extractions without feedback control. For convenience of description, we refer to the CP-work extraction which

is strong and unital at the same time as the CPSU-work extraction. Because the CPSU-work extraction is the

work extraction without feedback control whose wj means the amount of the extracted work, it is reasonable

to consider all natural thermodynamical work extractions to be the CPSU-work extraction.

3.2.2 FQ-work extraction

In the previous subsection 3.2.1, we have focused on the internal system, and defined the CP-work extraction. In

the present subsection, we consider the dynamics of the total system IEX which realizes the CP-work extraction

as the time evolution of the internal system I. As the minimal requirement, we demand that the time evolution

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of the total system IEX conserves the average of energy of total system;

Definition 4 (Fully quantum (FQ) work extraction). Let us consider an external system HEXwith the Hamil-

tonian HEX . If the unitary transformation U on HI ⊗ HEX and the initial state ρEX on HEX satisfy the

following equation for any state ρ on HI , we refer to the set (HEX, HEX

, ρEX, U) as the FQ work extraction:

TrHIρ + TrHEX ρEX = Tr(HI + HEX )U(ρ ⊗ ρEX )U†. (3.56)

We can reduce the FQ work extraction easily to the CP-work extraction (3.35) as follows. Let us denote the

spectral decomposition of HEXby HEX

=∑

j hE|jPE|j , where PE|j is the projection to the energy eigenspace

of HEX whose eigenvalue is hE|j . We also define the CP map Ej on HI as Ej(ρ) := TrE [U(ρ ⊗ ρEX )U†PE|j ].

Finally, we define the measured value wj as wj := hE|j−TrHEXρEX

. We thereby obtain the CP-work extraction

corresponding to the FQ work extraction. Hereafter, we refer to the above mapping from the FQ-work extraction

to the CP-work extraction as FQ-CP map. We also refer to the CP-work extraction as {Ej , wj}(HEX,HEX

,ρEX,U)

when the FQ-CP map reduces the FQ work extraction (HEX ,HEX , ρEX , U) to it.

Similarly as the definition 1, the definition 4 is too general for practical purpose. Thus, we introduce two

classes of the FQ-work extraction. The element of the first class reduces to the CP-strong work extraction,

and the element of the second class reduces to the CP-unital work extraction. The first class is used in

Refs. [31, 33–37];

Definition 5 (FQ-strong work extraction). Let us consider an external system HEXwith the Hamiltonian

HEX. If the set (HEX

,HEX, ρEX

, U) satisfies the following condition, we refer to the set (HEX,HEX

, ρEX, U)

as the FQ-strong work extraction:

Condition FQS1 The initial state ρEXis a pure energy eigenstate of HEX

or a mixture of pure energy eigen-

states whose eigenvalues are the same.

Condition FQS2 The unitary U satisfies

[U,HI + HEX ] = 0. (3.57)

Lemma 4. An arbitrary FQ-strong work extraction reduces to a CP-strong work extraction by the FQ-CP map.

Proof: Let us take an arbitrary FQ-strong work extraction (HEX ,HEX , ρEX , U). By the FQ-CP map, we

reduces (HEX ,HEX , ρEX , U) into the CP-work extraction {Ej , wj}(HEX,HEX

,ρEX,U). We also take an arbitrary

normalized eigenvector |x⟩ of HI with an eigenvalue hx, and denote the spectral decomposition of HI as

HI =∑

h hPh, where Ph is the projection to the energy eigenspace of HI whose eigenvalue is h. Because of

Condition FQS1, and because the unitary U satisfies the energy conservation (3.57), the state Ej(|x⟩⟨x|)/pj

is a pure energy eigenstate of HI or a mixture of pure energy eigenstates whose eigenvalues are the same.

Note that wj is defined as hE|j − Tr[HEXρEX], by the FQ-CP map. Thus, because of Condition FQS1 and

because the unitary U satisfies the energy conservation (3.57), the state Ej(|x⟩⟨x|)/pj has the energy eigenvalue

hx−wj . Thus, the unnormalized state Ej(|x⟩⟨x|) and the measured value wj satisfy (3.37). Hence, the CP-work

extraction {Ej , wj}(HEX,HEX

,ρEX,U) is the CP-strong work extraction. ¤

Next, we introduce the second class of the FQ-work extraction, whose element reduces to the CP-unital

work extraction by the FQ-CP map. It is given by generalizing the work storage introduced in Ref. [12].

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Definition 6 (FQ-memoryless work extraction). We refer to an FQ-work extraction (HEX,HEX

, ρEX, U) which

satisfies the following conditions as the FQ-memoryless work extraction:

Condition FQM1 The external system EX is a non-degenerate system, or a composit system of a non-

degenerate system EX1 and a fully degenerate system EX2. The initial state of EX is the product state

of a pure energy eigenstate |l⟩EX1 of EX1 and a mixed state ρEX2 :=∑

i pi|i⟩EX2⟨i|EX2 of EX2, where

{|i⟩EX2} is an orthonormal basis of HEX2 .

Condition FQM2 The unitary U is written as

U =∑

i

Ui,IEX1 ⊗ |i⟩EX2⟨i|EX2 , (3.58)

where each Ui,IEX1 is the unitary on IEX2 such that the following CP-map only depends on i and l − l′;

E il,l′(ρI) := TrEX

[|l′⟩EX1⟨l′|EX1Ui,IEX1(|l⟩EX1⟨l|EX1 ⊗ ρI)U†i,IEX1

|l′⟩EX⟨l′|EX

]. (3.59)

Namely, E il,l′ = E i

l+δl,l′+δl holds for an arbitrary δl.

The subsystem EX1 means a work storage, and the subsystem EX2 means a noise source. We refer to

an FQ-memoryless work extraction without the noise source as the FQ-memoryless work extraction without

noise. When a CP-work extraction {Ej , wj} is reduced from an FQ-memoryless work extraction, the CP-work

extraction {Ej , wj} can be written with a probability {p(m)} and the CP-work extractions {F [m]j , wj} which

are reduced from the FQ-memoryless work extractions without noise as follows:

Ej =∑m

pmF [m]j . (3.60)

There are two points in the definition 6. First, in order to satisfy Condition FQM2, the dimension of the

work storage EX1 should be infinite.

Second, we can interpret the FQ-memoryless work extraction as the work extraction without memory effect.

Let us consider the situation that we perform CP-work extractions n times. Let the kth CP-work extraction is

reduced from the FQ work extraction (HEX,HEX

, ρ(k)E , U), and let ρ

(k)E be the final state of the external system

of the k−1th work extraction. Therefore, if the FQ work extraction (HEX , HEX , ρ(k)E , U) is not FQ-memoryless,

the kth CP-work extraction depends on the outcomes of the previous CP-work extractions. Namely, there exists

a memory effect. If the FQ work extraction (HEX,HEX

, ρ(k)E , U) is FQ-memoryless, then the memory effect

does not exist, because of Condition FQM2. Thus, when we perform a CP-work extraction which is reduced

from an FQ-memoryless work extraction, we don’t have to initialize the external system after the projective

measurement on the external system.

Lemma 5. An arbitrary FQ-memoryless work extraction reduces to a CP-unital work extraction by the FQ-CP

map.

Proof: Because of (3.60), we only have to prove an arbitrary FQ-memoryless work extraction without noise

reduces to a CP-unital work extraction. Namely, we only have to prove

∑l′

El,l′(1I) = 1, for any l (3.61)

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where

El,l′(ρI) := TrEX [|l′⟩EX ⟨l′|EX U(|l⟩EX ⟨l|EX ⊗ ρI)U†|l′⟩EX ⟨l′|EX ]. (3.62)

Because of El,l′ = El+δl,l′+δl for an arbitrary δl, we obtain (3.61) as follows;

∑l′

El,l′(1I) =∑l′

El′,−l(1I) (3.63)

=∑l′

TrEX[| − l⟩EX

⟨−l|EXU(|l′⟩EX

⟨l′|EX⊗ 1I)U†| − l⟩EX

⟨−l|EX] (3.64)

= TrEX [| − l⟩EX ⟨−l|EX U(1EX ⊗ 1I)U†| − l⟩EX ⟨−l|EX ] (3.65)

= 1I . (3.66)

¤So far, we have considered the mapping from the FQ-work extraction to the CP-work extraction. How about

the converse mapping? As we show in the following theorem, we can always find an FQ-work extraction which

reduces to an arbitrary CP-work extraction;

Theorem 2. For an arbitrary CP-work extraction {Ej , wj}, there exists an FQ-weak work extraction (HEX ,HEX , ρEX , U)

which reduces to {Ej , wj} by the FQ-CP map.

Proof: We only have to prove that we can take an FQ work extraction (HEX,HEX

, ρEX, U) which can

produce an arbitrary CP-work extraction {Ej , wj}. Let {Ej,m} be a set of operation elements for {Ej}; namely,

Ej(ρ) =∑m

Ej,mρE†j,m (3.67)

holds for an arbitrary state ρ. Introduce the external system EX with an orthonormal basis set {|j,m⟩EX} and

introduce the Hamiltonian of EX as HEX :=∑

j wjPj , where Pj :=∑

m |j,m⟩EX ⟨j,m|EX . Let us define the

unitary U on IEX as

U |x⟩I |0, 0⟩EX=

∑j,m

Ej,m|x⟩I |j,m⟩EX, (3.68)

where |0, 0⟩EX is an eigenstate of HEX whose eigenvalue we set to zero. Then,

Ej(ρ) = TrEX[PjU(ρ ⊗ |0, 0⟩⟨0, 0|)U†Pj ] (3.69)

holds for arbitrary ρ. Let us prove that the set (HEX ,HEX , |0, 0⟩⟨0, 0|, U) satisfies (3.56). Because of HEX :=∑j wjPj and (3.69),

∑j

wjTrEj(ρ) + TrHIEj(ρ) = Tr[(HI + HEX )U(ρ ⊗ |0, 0⟩⟨0, 0|)U†] (3.70)

holds. Thus, because of (3.35) and Tr[HEX|0, 0⟩⟨0, 0|] = 0,

Tr[HIρ] + Tr[HEX|0, 0⟩⟨0, 0|] = Tr[(HI + HEX

)U(ρ ⊗ |0, 0⟩⟨0, 0|)U†] (3.71)

holds, and hence the set (HEX,HEX

, |0, 0⟩⟨0, 0|, U) is an FQ work extraction which yields the CP-work extraction

{Ej , wj}. ¤

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Now, let us revisit Question 2 in the section 3.1. Because the CP-work extraction only describes the time

evolution of the internal system I, we need to show the existence of the time evolution of total system IEX

such that we can know the amount of the energy gain of EX from observing EX . Theorem 2 guarantees the

existence of the time evolution. We can realize an arbitrary CP-work extraction as the internal part of the time

evolution of total system IEX such that we can know the amount of the energy gain of EX from observing EX .

In the present subsection, we have formulated the FQ-work extraction, and given two classes of it. The first

class is the FQ-strong work extraction, whose element reduces to the CP-strong work extraction. The second

class class is the FQ-strong work extraction, whose element reduces to the CP-strong work extraction by the

FQ-CP map. For the convenience of description, we refer to an FQ-work extraction which is FQ-strong and

FQ-memoryless at the same time as the FQSM-work extraction. Clearly, an arbitrary FQSM-work extraction

reduces to a CPSU-work extraction by the FQ-CP map. We also have shown that we can always find an

FQ-work extraction which reduces to an arbitrary CP-work extraction.

For a CP-work extraction, there are many FQ-work extractions which reduces to the CP-work extraction

by FQ-CP map. Thus, for practical use, it is to be desired that we can find the FQ-work extraction which has

a good feature, e.g., the FQ-memoryless work extraction. In the next section, we will consider this problem for

the CPSU-work extraction. To be concrete, we will give a converse mapping from the CPSU-work extraction

to the FQSM-work extraction. As a by-product, we will give a powerful tool to analyze the thermodynamic

features of heat engines which are described as the FQSM-work extraction or the CPSU-work extraction.

3.3 Converse mapping from the CPSU-work extraction to the FQSM-

work extraction

3.3.1 Fully classical model

First of all, we introduce a model of fully classical work extraction and give the map from the semi-classical

work extractions, the CPSU-work extractions or the FQSM-work extraction to the classical model.

Definition 7 (Classical work extraction). We consider a classical system X and its Hamiltonian which is given

as a real-valued function hX on X . We also consider a probabilistic dynamics T (x′|x) on X , which is a transition

probability, i.e.,∑

x′ T (x′|x) = 1. With the probabilistic dynamics T (x′|x), the initial distribution P (x) becomes

the final distribution as in P ′(x′) :=∑

x T (x′|x)P (x). Because of the energy conservation the amount of the

extracted work between the initial and final states x and x′ is wx,x′ = hX(x)− hX(x′). An arbitrary value w of

extracted work is realized with the probability∑

x,x′ P (x)T (x′|x)δhX(x)−hX(x′),w. When the transition probability

is a bi-stochastic matrix, i.e.,∑

x T (x′|x) = 1 holds, we refer to T (x′|x) as a classical unital work extraction.

This model includes the previous fully classical scenario, in which we extract work from classical systems.

For example, the set up of the Jarzynski equality [7] is a special case that T (x′|x) is deterministic and unital.

The classical unital work extractions correspond to the classical work extractions without feedback, and the

classical non-unital work extractions correspond to the classical work extractions with feedback. We can map

an arbitrary CP-work extraction to a classical model as follows:

Definition 8 (classical description). Let us perform a CP-work extraction {Ej , wj} on an arbitrary classical

state, which is written as ρI =∑

x P (x)|x⟩⟨x|, where {|x⟩}x∈X is the energy eigenbasis of HI . Let us take a

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classical system whose set of states is X and whose hamiltonian h(x) as h(x) := ⟨x|HI |x⟩. We refer to the

following bi-stochastic matrix T{Ej ,wj}(x′|x) as the classical description of the CP-work extraction {Ej , wj}:

T{Ej ,wj}(x′|x) :=

∑j

⟨x′|Ej(|x⟩⟨x|)|x′⟩ (3.72)

We refer to the map from the CP-work extraction to its classical description as CP-C map. By using the FQ-CP

map and the CP-C map at the same time, we can define the classical description T(HEX,HEX

,ρEX,U)(x′|x) of an

FQ-work extraction;

T(HEX,HEX

,ρEX,U)(x′|x) := T{Ej ,wj}(HEX

,HEX,ρEX

,U)(x′|x). (3.73)

The relationship between a CP-work extraction and its classical description is shown as in the following

lemma:

Lemma 6. Let us perform an arbitrary CP-work extraction {Ej , wj} on an arbitrary classical state ρI =∑x P (x)|x⟩⟨x|, where {|x⟩}x∈X is the energy eigenbasis of HI . The CP-work extraction and its classical de-

scription have the same average of the extracted work;

∑j

wjTr[Ej(ρI)] =∑x,x′

P (x)T{Ej ,wj}(x′|x)wx,x′ . (3.74)

When the CP-work extraction is CP-strong, the CP-strong work extraction and its classical description have the

same distribution of the extracted work;

∑j

Tr[Ej(ρI)]δw,wj =∑x,x′

P (x)T{Ej ,wj}(x′|x)δh(x)−h(x′),w. (3.75)

When the CP-work extraction is CP-unital, its classical description is also unital, i.e.,∑

x T{Ej ,wj}(x′|x) = 1

holds. Similarly, an arbitrary FQ-strong work extraction and its classical description have the same distribution

of the extracted work;

∑j

Tr[Ej(ρI)]δwj ,w =∑x,x′

P (x)T(HEX,HEX

,ρEX,U)(x′|x)δh(x)−h(x′),w, (3.76)

and an arbitrary FQ-memoryless work extraction’s classical description is unital.

Proof of Lemma 6: Because of (3.35) and ρI =∑

x P (x)|x⟩⟨x|, we obtain (3.74) as follows;

∑j

wjTr[Ej(ρI)](a)= Tr[HIρI ] −

∑j

Tr[HIEj(ρI)], (3.77)

=∑x′

⟨x′|HIρI |x′⟩ −∑x′

∑j

⟨x′|HIEj(ρI)|x′⟩ (3.78)

(b)=

∑x,x′

P (x)⟨x′|HI |x⟩⟨x|x′⟩ −∑x,x′

∑j

P (x)⟨x′|HIEj(|x⟩⟨x|)|x′⟩, (3.79)

(c)=

∑x

P (x)h(x) −∑x,x′

P (x)h(x′)T{Ej ,wj}(x′|x), (3.80)

(d)=

∑x,x′

P (x)T{Ej ,wj}(x′|x)wx,x′ (3.81)

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where the equality (a) follows from (3.35), the equality (b) follows from ρI =∑

x P (x)|x⟩⟨x|, the equality (c)

follows from HI =∑

x h(x)|x⟩⟨x| and (3.72), the equality (d) follows from the definition of wx,x′ .

Similarly, we obtain (3.75) as follows;

∑j

Tr[Ej(ρI)]δw,wj =∑

j

∑x′

⟨x′|Ej(ρI)|x′⟩δw,wj (3.82)

(a)=

∑j

∑x,x′

P (x)⟨x′|Ej(|x⟩⟨x|)|x′⟩δw,wj (3.83)

(b)=

∑j

∑x,x′

P (x)⟨x′|Ej(|x⟩⟨x|)|x′⟩δwj ,h(x)−h(x′)δw,wj (3.84)

=∑

j

∑x,x′

P (x)⟨x′|Ej(|x⟩⟨x|)|x′⟩δwj ,h(x)−h(x′)δw,h(x)−h(x′) (3.85)

(c)=

∑j

∑x,x′

P (x)⟨x′|Ej(|x⟩⟨x|)|x′⟩δw,h(x)−h(x′) (3.86)

(d)=

∑x,x′

P (x)T{Ej ,wj}(x′|x)δh(x)−h(x′),w. (3.87)

where the equality (a) follows from ρI =∑

x P (x)|x⟩⟨x|, the equalities (b) and (c) follow from (3.37), and the

equality (d) follows from (3.72). Because an arbitrary FQ-strong work extraction reduces to a CP-strong work

extraction by the FQ-CP map, the equation (3.76) also holds.

Finally, we obtain∑

x T{Ej ,wj}(x′|x) = 1 for an arbitrary CP-unital work extraction {Ej , wj}, as follows;

∑x

TEj ,wj (x′|x) =

∑x

∑j

⟨x′|Ej(|x⟩⟨x|)|x′⟩ (3.88)

= ⟨x′|∑

j

Ej(∑

x

|x⟩⟨x|)|x′⟩ (3.89)

= ⟨x′|∑

j

Ej(1I)|x′⟩ (3.90)

= ⟨x′|1I |x′⟩ = 1, (3.91)

where 1I is the identity operator of I. Because an arbitrary FQ-memoryless work extraction reduces to a CP-

unital work extraction by FQ-CP map, and thus the classical description of an arbitrary FQ-memoryless work

extraction is also unital. ¤

3.3.2 Converse mapping from the CPSU-work extraction to the FQSM-work ex-

traction

As we show in the following theorem, for an arbitrary CPSU-work extraction, we can always find an FQSM-work

extraction whose classical description is the same as the classical description of the CPSU-work extraction.

Theorem 3. For an arbitrary CPSU-work extraction {Ej , wj}, there exists an FQSM-work extraction (HEX,HEX

, ρEX, U)

which satisfies

T(HEX,HEX

,ρEX,U)(x′|x) = T{Ej ,wj}(x

′|x). (3.92)

Lemma 6 guarantees that two CP-strong work extractions whose classical descriptions are the same have

the same distribution of the extracted work. Thus, Theorem 3 guarantees that for an arbitrary CPSU-work

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{Ej , wj}

{Fj , wj}(HEX

,HEX, ρEX

, U)

{Ej{E{E , w, wj, wj}{Ej{E{E jj

FQ-CPmap CP-Cmap

T (x′|x)

FQSM CPSU Classical unital

Figure 3.1: Schematic diagram of converse mapping from CPSU to FQSM. Theorem 3 guarantees that for anarbitrary CPSU-work extraction {Ej , wj}, we can always find an FQSM-work extraction (HEX

,HEX, ρEX

, U)which is reduced to CPSU-work extraction {Fj , wj} whose distribution of the extracted work is the sameas {Ej , wj}. Lemma 7 and Corollary 2 guarantee that for an arbitrary classical work extraction T (x′|x) wecan always find an FQSM-work extraction (HEX

,HEX, ρEX

, U) and a CPSU-work extraction {Fj , wj} whoseclassical description is T (x′|x).

extraction {Ej , wj}, we can always find an FQSM-work extraction (HEX ,HEX , ρEX , U) which is reduced to

CPSU-work extraction {Fj , wj} whose distribution of the extracted work is the same as {Ej , wj} (Fig.3.3.2).

Theorem 3 can be easily shown by using the following lemma;

Lemma 7. There exists an FQSM-work extraction which has the same classical description as an arbitrary

classical model. Namely, for an arbitrary bi-stochastic matrix T (x′|x), there exists an FQSM-work extraction

(HEX,HEX

, ρEX, U) which satisfies T (x′|x) = T(HEX

,HEX,ρEX

,U)(x′|x).

Lemma 7 has an important corollary;

Corollary 2. We can always find a CPSU-work extraction {Fj , wj} whose classical description is the same as

an arbitrary classical work extraction T (x′|x).

We can give the CPSU-work extraction as {Fj , wj} := {Ej , wj}(HEX,HEX

,ρEX,U). Note that a CPSU-work

extraction and its classical description have the same distribution of the extracted work. Thus, for an arbitrary

classical work extraction, we can take a CPSU-work extraction whose probabilistic distribution of the extracted

work is the same as that of the classical work extraction. This fact is very useful; we can analyze classical

models as a substitution for quantum heat engines, which are described as the CPSU-work extraction. We use

the fact in Chapter 4.

We prove Theorem 3 and Lemma 7 in the next subsection. As a by-product, we will clarify the relationship

between our work extraction scenario and the semi-classical work extraction scenario.

3.3.3 Relationship between our scenario and semi-classical scenario

In the same way as the definition 8, we can give the classical description of the semi-classical work extraction.

Definition 9 (classical description of semi-classical work extraction). Let us perform a semi-classical work

extraction UI on an arbitrary classical state, which is written as ρI =∑

x P (x)|x⟩⟨x|, where {|x⟩}x∈X is the

energy eigenbasis of HI . Let us take a classical system whose set of states is X and whose hamiltonian h(x)

as h(x) := ⟨x|HI |x⟩. We refer to the following bi-stochastic matrix TUI(x′|x) as the classical description of the

semi-classical work extraction UI :

TUI (x′|x) := ⟨x′|UI |x⟩⟨x|U†

I |x′⟩ (3.93)

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We refer to the map from the semi-classical extraction to its classical description as U-C map.

The relationship between our scenario and semi-classical scenario is given by the following lemma. It is also

used to prove Theorem 3 and Lemma 7.

Lemma 8. There exists an FQSM-work extraction without noise (HEX,HEX

, ρEX, U) which has the same clas-

sical description as an arbitrary semi-classical work extraction with the time evolution UI . Namely, TUI (x′|x) =

T(HEX,HEX

,ρEX,U)(x′|x) holds. Conversely, for an arbitrary FQSM-work extraction without noise (HEX

,HEX, ρEX

, U),

there exists a semi-classical work extraction UI which satisfies TUI(x′|x) = T(HEX

,HEX,ρEX

,U)(x′|x).

The relationship among our scenario, the semi-classical work extraction, and the classical unital work ex-

traction can be drawn as Fig.3.2. There exists one-to-one correspondence between the FQSM work extractions

without noise and the semi-classical work extractions, in the sense those classical descriptions are the same.

There also exists one-to-one correspondence between the FQSM work extractions and the classical unital work

extractions. In the above sense, the semi-classical work extraction and the classical unital work extraction are

included in our work extraction scenario.

map

to th

e cla

ssica

l descriptio

ncla

ssica

l descriptio

nmap

to th

e

FQSM work extraction

FQSM work extractionwithout noise

map to the

classical description

internal unitarywork extraction

classical unital work extraction

correspondingone-to-onethrough

the classical description

Figure 3.2: The schematic graph of the relationships among the FQSM work extraction, the internal workextraction and the fully classical work extraction. There exists one-to-one correspondence between the FQSMwork extractions without noise and the semi-classical work extractions, in the sense those classical descriptionsare the same. There also exists one-to-one correspondence between the FQSM work extraction and the classicalunital work extraction

Let us prove Theorem 3, Lemma 7 and Lemma 8. We firstly prove Lemma 8, and secondly prove Lemma 7,

and finally prove Theorem 3.

Proof of Lemma 8: We first prove the first statement; we fix an arbitrary unitary transformation

UI . Let us give the FQSM-work extraction without noise (HEX,HEX

, ρEX, V ) which satisfies TUI

(x′|x) =

T(HEX,HEX

,ρEX,V )(x′|x). We choose a suspended weight as the external system. Namely, the Hilbert space

HEX is L2(R) and its Hamiltonian HEX is∑

j∈R j|j⟩⟨j|, where {|j⟩}j∈R is an orthonomal basis set of HEX .

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Then, the following (HEX,HEX

, ρEX, V ) is the memoryless work extraction without noise which we are seeking;

V |j⟩|x⟩ :=∑

y

uy,x|j + h(x) − h(y)⟩|y⟩, where uy,x := ⟨y|UI |x⟩, (3.94)

wj := j. (3.95)

Because the unitary V clearly commutes with HI +HEX and because the initial state |0⟩ of the external system

is a pure eigenstate, (HEX,HEX

, ρEX, V ) is an FQ-strong work extraction. Because of (3.94), the CP-map

Ej0j (ρ) := TrEX

[|j⟩⟨j|V (|j0⟩⟨j0| ⊗ ρ)V †|j⟩⟨j|] (3.96)

depends only on j−j0, and thus (HEX,HEX

, ρEX, V ) is an FQ-memoryless work extraction without noise. Thus,

(HEX,HEX

, ρEX, V ) is an FQSM-work extraction. Finally, we show TUI

(x′|x) = T(HEX,HEX

,ρEX,V )(x′|x);

T(HEX,HEX

,ρEX,V )(x′|x) =

∑j

Tr[⟨x′|Ej(|x⟩⟨x|)|x′⟩] (3.97)

=∑

j

⟨x′|TrEX[|j⟩⟨j|V (|0⟩⟨0| ⊗ |x⟩⟨x|)V †|j⟩⟨j|]|x′⟩ (3.98)

= TrEX [⟨x′|V (|0⟩⟨0| ⊗ |x⟩⟨x|)V †|x′⟩] (3.99)

= |ux′,x|2 = ⟨x′|UI |x⟩⟨x|U†I |x

′⟩ = TUI(x′|x). (3.100)

Next, we prove the second statement. We take an arbitrary FQSM-work extraction without noise (HEX,HEX

, ρEX, U).

Note that an arbitrary FQSM-work extraction (HEX , HEX , ρEX , U) can be written as follows:

U |l⟩EX|x⟩I =

∑y

fx,y|l + ∆(h(x) − h(y))⟩EX|y⟩I , (3.101)

where fx,y is a matrix of the complex numbers, and |l + ∆(x, y)⟩ is the energy eigen vector of HEX with its

energy eigenvalue el + h(x)− h(y), and where el is the energy eigenstate of |l⟩EX. Then, VI |x⟩ :=

∑y fx,y|y⟩ is

the unitary transformation on HI which we are seeking. Because TVI(x′|x) = T(HEX

,HEX,ρEX

,U)(x′|x) = f(x, x′)

clearly holds, we only have to prove that VI is unitary. In order to show the unitarity of VI , it is enough to

show the unitarity of fx,y. Because U is unitary, UU† = 1 and U†U = 1 hold. The equation UU† = 1 yields

the equation∑

y fx,yf∗x′,y = δx,x′ , as follows;

UU† =∑

x,y,l,x′,y′,l′

fx,yf∗x′,y′ |l + ∆(h(x) − h(y))⟩|y⟩⟨l′ + ∆(h(x) − h(y))|⟨y′|δx,x′δl,l′ ,(3.102)

⟨L|⟨y|UU†|L′⟩|y′⟩ =∑x,l

fx,yf∗x,y′δL,l+∆(h(x)−h(y))δL′,l+∆(h(x)−h(y′)) (3.103)

=∑

x

fx,y′f∗x,y′δL′,L+∆(h(y)−h(y′)) (3.104)

Thus, in order to ⟨L|⟨y|UU†|L′⟩|y′⟩ = δy,y′δL,L′ , the equation∑

x fx,yf∗x,y′ = δy,y′ has to hold. Similary, the

equation U†U = 1 yields the equation∑

y f∗x′,yfx,y = δx,x′ . Thus, the matrix fx,y is unitary, and thus VI is also

unitary. ¤

Proof of Lemma 7: We can express the bi-stochastic matrix T (x′|x) with the probability {p(i)} and permu-

tation matrices D[i]x′,x as T (x′|x) =

∑i p(i)D[i]

x′,x [60]. Because the permutation matrix is unitary, there exists an

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FQSM-work extraction without noise (HEX1 ,HEX1 , ρEX1 , U[i]IEX1

) which satisfies D[i]x′,x = T

(HEX1 ,HEX1 ,ρEX1 ,U[i]IEX1

)(x′|x).

Let us substitute U[i]IEX1

for Ui,IEX1 of (3.58). Then, the FQSM-work extraction (HEX,HEX

, ρEX, U) in the defi-

nition 6 becomes the FQSM-work extraction whose classical description satisfies T (x′|x) = T(HEX,HEX

,ρEX,U)(x′|x).

¤Proof of Theorem 3: The classical description T{Ej ,wj}(x

′|x) is a bi-stochastic matrix, we can take the

FQSM-work extraction (HEX,HEX

, ρEX, U) which satisfies (3.92), because of Lemma 7. ¤

In the present chapter, we have reconsidered the formulation of the work extraction from the viewpoint of

quantum measurement theory, and clarified a serious conflict between the semi-classical scenario and the fully

quantum scenario. We gives a trade-off inequality which means that we have to destroy the coherence of the

thermodynamic system in order to know the amount of the extracted energy; namely, a work extraction must

be a measurement. Based on the fact, we have formulated the work extractions as a measurement process, and

putted the previous formulations in order in a hierarchical structure. As a by-product, our formulation gives

us a powerful tool to analyze the thermodynamic features of quantum heat engines; when the initial state is

classical, we can analyze the classical model as a substitution for quantum heat engines.

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Chapter 4

Finite-size Thermodynamics

In the present chapter, we give a useful method clarifying thermodynamic features of the mesoscopic system,

which consists of a very large, but finite number of particles. To deal with finitely large values of particle number

n, we need two analytical tools in the information theory; namely, the information geometry [59] and the strong

large deviation theory [46, 47]. Using these tools, we firstly rederive a thermodynamical upper bound for the

efficiency of finite-size heat engines with two heat baths that are composed of n identical particles. Next, we

asymptotically expand the upper bound in terms of qn := QH,n/n, where the QH,n is the extracted heat from

the hot heat bath. In the case that the heat baths ’particle are uncorrelated each others, we can construct

a concrete CPSU-work extraction {Ej , wj} whose efficiency coincides with the upper bound up to the term of

the first order qn; namely, thermodynamics gives an approximation to the optimal efficiency which is accurate

up to the the order of qn in general. In the case that QH,n is a non-decreasing function of n, the efficiency of

{Ej , wj} coincides the upper bound up to the term of the second order q2n; in that case, thermodynamics gives

an approximation to the optimal efficiency which is accurate up to the the order of q2n.

4.1 Carnot’s Theorem for finite-size systems

4.1.1 Heat engine with n-particle heat baths

As the internal system, let us consider the following four-body system; the working body S, the hot and cold

heat baths BH and BL respectively, and a parameter controller. We focus on the heat baths that are composed

of n paticles each of which has d energy levels. We treat the particles as n qudits; we consider only the particles’

internal degrees of freedom, not their positions and momenta. We also treat the heat engine S as a D-level

system. Thus, our setup includes finite-particle heat engines; e.g., D = dl when the heat engine S is composed

of l particles with d-levels.

The Hamiltonian of the internal system is written as

HI =∑

λ

HSBHBL(λ) ⊗ |λSC ⟩⟨λSC |, (4.1)

HSBHBL(λ) = HS(λ) + HSBH

(λ) + HSBL(λ) + HBH

+ HBL(4.2)

The system Hamiltonian HS(λ) describes a mechanical operation on S through the parameter λ, e.g., the volume

of the gas or an applied magnetic field. Similary, HSBH (λ) is the interaction Hamiltonian between S and BH ,

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while HSBL(λ) is the one between S and BL. They describe, for example, the attachment or detachment of BH

and BL to S.

On the above internal system, we perform the CPSU-work extraction {Ej , wj} on the internal system.

Initially, the system S is in an arbitrary state ρSini, the controller SC is in a pure state |λi⟩, and the heat

baths BH and BL are in Gibbs states at the inverse temperatures βH and βL, respectively. We assume that

both heat baths BH and BL are initially in Gibbs state ρG,βH (HBH ) := exp(−βHHBH )/tr[exp(−βHHBH )] and

ρG,βL(HBL) := exp(−βLHBL)/tr[exp(−βLHBL)].

In order to consider cyclic operations, we also assume that the states of the working body S and the controller

SC after the CPSU-work extraction {Ej , wj} are the same as the initial states for every measurement outcome

j;

trBHBL[Ej(ρini)] = ρS

ini ⊗ |λi⟩⟨λi| for any j. (4.3)

Thus, in our model, the cyclic thermodynamical process is the transformation of the internal sytem from the

initial state ρini := ρSini ⊗ ρG,βH

(HBH) ⊗ ρG,βL

(HBL) to the final state ρj

fin := Ej(ρini)/pj with the probability

pj := tr[Ej(ρini)]. We refer to the cyclic thermodynamic process with the n-particle heat baths as an n-particle

thermodynamic operation. The average work W(n)ext ({Ej , wj}) extracted during the n-particle thermodynamic

operation {Ej , wj} is given by the average of wj , which is equal to the energy loss of the internal system:

W(n)ext ({Ej , wj}) :=

∑j

pjwj = tr[HI(ρini −∑

j

pjρjfin)]. (4.4)

The heat QH,n({Ej , wj}) extracted from BH to S is given by the average energy loss of BH :

QH,n({Ej , wj}) := tr[HBH (ρBH

ini −∑

j

pjρj,BH

fin )], (4.5)

where ρj,BH

fin = trSBLSC[ρj

fin]. The efficiency η(n)({Ej , wj}) is defined as

η(n)({Ej , wj}) :=W

(n)ext ({Ej , wj})

QH,n({Ej , wj}). (4.6)

4.1.2 Upper bound for the efficiency of heat engines with n-particle heat baths

In the following theorem, we give a general upper bound for the efficiency, using the relative entropy D(ρ||σ) :=

tr[ρ(log ρ − log σ)], the energy average U(β,H) := tr[ρG,β(H)H] and the von Neumann entropy S(β,H) =

S(ρG,β(H)) := −tr[ρG,β(H) log ρG,β(H)], of each particle of the heat baths:

Theorem 4 (General upper bound of efficiency). When an n-particle thermodynamic operation {Ej , wj} has a

constant extracted heat QH,n, the efficiency η(n)({Ej , wj}) is bounded as follows;

η(n)({Ej , wj}) ≤(

1 − βH

βL

)−

D(ρG,β′H

(HBH)||ρG,βH

(HBH)) + D(ρG,β′

L(HBL

)||ρG,βL(HBL

))βLQH,n

, (4.7)

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where the real numbers β′H and β′

L are determined by

U(βH , HBH ) − U(β′H , BH) = QH,n, (4.8)

S(β′H ,HBH

) + S(β′L,HBL

) = S(βH , HBH) + S(βL,HBL

). (4.9)

The upper bound (4.7) is an extension of Carnot’s inequality. It is not be the optimal bound, but it is a

good approximation of the optimal bound in the case that the heat baths’ particle are uncorrelated each others;

the Hamiltonian of the n-particle heat baths are written as HBH=

∑nk=1 H

[k]BH

and HBL=

∑nk=1 H

[k]BL

, where

H[k]BH

= H[k]BL

:= HB are the Hamiltonian of the kth particle of BH and BL, respectively. The upper bound (4.7)

approximates the optimal bound up to the order of q2n. To see this, we next asymptotically expand (4.7). In

order to describe the asymptotic expansion, we introduce the energy variance and the energy skewness of each

particle of the heat baths: σ2(β) := tr[ρβH2B ] − tr[ρβHB ]2 and γ1(β) = tr[ρG,β(HB − U(β))3]/σ3(β).

Theorem 5 (Extended Carnot’s Theorem). When n-particle thermodynamic operations {{Ej , wj}}∞n=1 have

extracted heats {QH,n}∞n=1 satisfying limn→∞ QH,n/n = 0, the upper bound (4.7) has an asymptotic expansion

as follows:

η(n)({Ej , wj}) ≤(

1 − βH

βL

)−

∞∑k=1

c(k)βH

qkn, (4.10)

where qn := QH,n/n and

c(1)βH ,βL

:=(

12β2

Hσ2(βH)+

12β2

Lσ2(βL)

)β2

H

βL(4.11)

c(2)βH ,βL

:=(− γ1(βH)

6β3Hσ3(βH)

+γ1(βL)

6β3Lσ3(βL)

+1

2β4Lσ4(βL)

+1

2β2Hβ2

Lσ2(βH)σ2(βL)

)β3

H

βL. (4.12)

On the other hand, for an arbitrary sequence of real numbers {qn} which satisfy qn → 0 at the limit n → ∞, we

can take the n-particle thermodynamic operations {Ej , wj} whose extracted heats {QH,n} satisfy qn

qn:= QH,n

nqn→ 1

at the limit n → ∞ and

η(n)({Ej , wj}) =(

1 − βH

βL

)− c

(1)βH ,βL

qn − c(2)βH ,βL

q2n − d

(1)βH ,βL

qn

n+ O

(q2n√n

)+ O

(q3n

), (4.13)

where

d(1)βH ,βL

:=(

(γ1(βH)

2βHσ(βH)+

1β2

Hσ2(βH))2 + (

γ1(βL)2βLσ(βL)

+1

β2Lσ2(βL)

)2)

β2H

βL. (4.14)

The inequality (4.10) is simply the Taylor expansion of (4.7) in terms of qn = QH,n/n. However, because

there exists {Ej , wj} which satisfies (4.13), the inequality approximates the upper limit up to the order of qn.

When the QH,n is a non-decreasing function of n, the inequality approximates the upper limit up to the order

of q2n. When the QH,n is a decreasing function of n, the inequality does not approximate the upper limit up

to the order of q2n, because of the term of order qn/n. However, QH,n is naturaly non-decreasing of n, because

macroscopic heat engines treat an extremely larger amount of energies than microscopic heat engines. Thus, we

can expect the inequality (4.10) approximates the upper limit up to the second order, in most cases. Note that

both of (4.10) and (4.13) converge into Carnot’s inequality at the limit of n → ∞; Thus, Theorem 5 gives a

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statistical mechanical proof of the achievability of the Carnot efficiency at the macroscopic limit, as a corollary.

4.1.3 Accuracy of thermodynamics in finite-size systems

As we show in Appendix C, we can derive (4.7) from thermodynamics; Theorem 4 means a microscopic derivation

of thermodynamical upper bound of the efficiency of heat engines with finite-size heat baths. Thus, Theorem 5

means that the difference between the thermodynamical upper bound and the optimal efficiency is at most in

the order of O(q2n) in case of the particles in each heat baths does not interact with each others. (Note: Theorem

4 holds even for the case that the particles in each heat baths interacts with each others, unlike Theorem 5.)

In order to illustrate the above fact, let us consider a concrete model, and plot Carnot’s bound, the thermo-

dynamical upper bound (4.7) and the asymptotic expansion (4.13). (Fig. 4.1.3 and Fig.4.1.3) As the internal

system, we take the heat baths which are the n-qubit systems, and the working body which is the 3-qubit

system. The Hamiltonian of the combined system SBHBL as follows:

HSBHBL= HS + HBH

+ HBL(4.15)

HS = 2(σ[1]z + σ[2]

z + σ[3]z ) (4.16)

HBH =n∑

jH=1

2σ[jH ]Z (4.17)

HBL=

n∑jL=1

2σ[jL]Z . (4.18)

We also take the external system the discrete infinite dimension system, whose Hamiltonian is

HEX =∞∑

kEX=−∞

kEX |kEX ⟩⟨kEX |. (4.19)

We assume the initial states of BH and BL to be Gibbs states at the temperatures 30K and 15K. For an

arbitrary FQSM-work extraction on SBHBLEX whose absorbed heat satisfies QH,n = 0.3n2/3, the efficiency of

the FQSM-work extraction is less than the purple line in Fig.4.1.3. On the other hand, there exists a concrete

FQSM-work extraction whose efficiency satisfies the blue line in Fig.4.1.3:

VSBHBLEX=

2n∑kBH

=1

1∑kS=0

2n∑kBL

=1

∞∑kEX

=−∞

|fn(kBH , kBL), kS , gn(kBH , kBL), kEX + kBH + kBL − fn(kBH , kBL) − gn(kBH , kBL)⟩⟨kBH , kS , kBL , kEX |

where |kBH⟩ and |kBL

⟩ are the k-th energy eigen states of BH and BL, and where

fn(kBH , kBL) := kBL − (⌈kBLd−n+mn⌉ − 1)dn−mn + (⌈kBH d−mn⌉ − 1)dmn (4.20)

gn(kBH, kBL

) := (kBH− (⌈kBH

d−mn⌉ − 1)dmn − 1)dn−mn + ⌈kBLd−n+mn⌉ (4.21)

mn :=

0.01n2/3 + 0.09n4/3

2nσ2(1/30)

log 2

(4.22)

To see the accuracy of (4.13) as an approximation of η(n)({Ej , wj}), we also plot the results of numerical

calculation for η(n)({Ej , wj})+O(e−nγ) in Fig.4.1.3, where γ is a positive constant value which will be explained

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S

W

B H

B L

QH,n = 0.3n2/3

n-qubit heat baths

n-qubit heat baths

30K

15K

HBH=

n∑

jH=1

2σ[jH ]Z

HBL=

n∑

jL=1

2σ[jL]Z

HEX=

∞∑

kEX=−∞

kEX|kEX

〉〈kEX|

Figure 4.1: qubit engine

in the proof section. Figure 4.1.3 shows that in the scale where the number of particle n is larger than 105,

the difference between the thermodynamical bound (4.10) and the asymptotic expansion (4.13) of the efficiency

η(n)({Ej , wj}) is small. Figure 4.1.3 shows that (4.13) is a very good approximation of η(n)({Ej , wj}) for the

case n ≥ 6000. Figure 2 also shows that (4.10) and (4.13) converge to Carnot’s bound in the macroscopic limit

n → ∞.

4.1.4 Effect of finiteness of the working body

We treat two kinds of finiteness, i.e., the finiteness of heat baths and the finiteness of working body. Now,

we discuss which finiteness is essential to decrease the optimal efficiency. In our set up of the n-particle

thermodynamic operation, the system (working body) S is composed can be finite with l particles. However,

the general upper bound (4.7) is independent of l, and we can perform {Ej , wj} for at least l ≥ 2 as the two-

qubit heat engine. Note that the finiteness of working body may indirectly restrict the optimal efficiency for

heat engines. In usual heat engines, only a portion of the total heat baths interacts with working body. The

volume of the portion is restricted by the surface area of working body. Thus, the effective number of particles

of the heat baths might depend on the surface area of the working body. Such an indirect finite-size effect of

the working body might affect the optimal efficiency for a particular model of heat engine. However, as for the

direct effect, the efficiency of heat engine is restricted only by the finiteness of heat baths.

4.2 Proof

4.2.1 Rough Sketch

We firstly overview the rough sketch of the proof of our theorems. A rigorous proof is given in the subsections

on and after 4.2.2.

General upper bound for efficiency: We derive the upper bound (4.7) in Theorem 4 from the following

expressions of η(n), which is given by the method of Ref. [8], which was shown in Chapter 3:

η({Ej , wj}) ≤(

1 − βH

βL

)− D(ρfin||ρini)

βLQH,n({Ej , wj}). (4.23)

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104

106

108

1010

0.36

0.38

0.40

0.42

0.44

0.46

0.48

0.50

unachievable zone

achievable zone

Particle number n

Efficie

ncy η

: Carnot efficiency

: General upper bound (4.7)

: Asymptotic expansion (4.13) up to 4th term

Figure 4.2: We plot Carnot’s bound, the thermodynamical upper bound (4.7) and our asymptotic expansion(4.13) up to its fourth term, as the red straight line, the purple curved line and the blue curved line, respectively.The horizontal axis is the number of particles n from 5000 to 1011, and the vertical axis is the efficiency. Weput the energy levels of each particle of heat baths to +kBJ and −kBJ , and the temperature of heat baths to30K and 15K, and the extracted heat to QH,n = 0.3n2/3kBJ . The blue region is the achievable zone, while thered region is the unachievable zone.

5000 1´104

2´104

5´104 1´10

5

0.15

0.20

0.25

0.30

0.35

0.40

Particle number n

Efficie

ncy η

: Asymptotic expansion (4.13) up to 4th term

: Asymptotic expansion (4.13) up to 3rd term

: Asymptotic expansion (4.13) up to 2nd term

: Numerical result of η(n)({Ej , wj})

Figure 4.3: We plot the asymptotic expansion (4.7) up to second term, the third term, and the fourth term,as the yellow dotted line, the green broken curve and the blue curve, respectively. We also plot the numericalresults of η(n)({Ej , wj}) + O(e−nγ) as the black dots. The horizontal axis is the number of particles n from2500 to 105, and the vertical axis is the efficiency. The energy levels, the temperatures of heat baths, and theextracted heat are the same as Fig.4.1.3.

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The inequality (4.23) implies that a lower bound of D(ρfin||ρini) gives an upper bound of η directly with the fixed

extracted heat; QH,n({Ej , wj}) = QH . Because {Ej , wj} is the weak work extraction, the transformation Λ(ρ) :=∑j Ej(ρ) is unital, and thus S(ρini) ≤ S(ρfin) holds. Hence, we minimize D(ρfin||ρini) with the constraints

QH = tr[HBH(ρBH

ini − ρBH

fin )], ρSini = ρS

fin and S(ρini) ≤ S(ρfin), and give (4.7) by substituting the minimum for

(4.23).

Asymptotic expansion of general upper bound for efficiency: As the former half part of Theorem

5, we derive the inequality (4.10). At first, we asymptotically expand D(ρG,β′X∥ρG,βX

) in the terms of ∆XS :=

S(β′X) − S(βX) (X is H or L):

D(ρG,β′X∥ρG,βX ) =

12β2

Xσ2(βX)(∆XS)2 + (

12β4

Xσ4(βX)+

γ1(βX)6β3

Xσ3(βX))(∆XS)3 + O((∆XS)4). (4.24)

Second, we investigate how ∆HS depends on n and QH,n. Solving (4.8), we obtain;

∆HS = −βHQH

n− 1

2β2Hσ2(βH)

(βHQH

n)2 + O((

βHQH

n)3). (4.25)

We also obtain ∆LS = −∆HS from (4.9). Finally, substituting (4.88), (4.25) and ∆LS = −∆HS for (4.7), we

obtain (4.10).

Classical model: Next, we prove the existence of the CPSU-work extraction which satisfies (4.13). First,

note that we have pointed out in the section 3.3 that for an arbitrary classical work extraction, we can take a

CPSU-work extraction whose probabilistic distribution of the extracted work is the same as that of the classical

work extraction. Thus, in order to show the existence of the CPSU-work extraction which satisfies the equality

(4.13), we only have to find a classical work extraction whose efficiency satisfies (4.13).

Let us give the classical work extraction whose efficiency satisfies (4.13). As the set of states of the classical

system X , we consider the set of natural numbers {jH , jL} where 1 ≤ jH ≤ dn and 1 ≤ jL ≤ dn. The initial

distribution of the classical system J is pn↓βH

(jH)pn↓βL

(jL), where pn↓βH

(jH) and pn↓βL

(jL) are the descending ordered

diagonal elements of ρ⊗nG,βH

and ρ⊗nG,βL

, respectively. The Hamiltonian of the classical system is hH(jH)+hL(jL),

where hH(jH) := hH(1)+ 1βH

logpn↓

βH(1)

pn↓βH

(jH)and hL(jL) := hL(1)+ 1

βLlog

pn↓βL

(1)

pn↓βL

(jL), and where hH(1) and hL(1) are

the ground energy of BH and BL. Because the classical system and its initial distribution corresponds to BHBL

and ρ⊗nG,βH

⊗ρ⊗nG,βL

, if there is a bi-stochastic matrix T (j′H , j′L|jH , jL) on J which satisfies (4.13), then there also

exists a CPSU-work extraction on BHBL which satisfies (4.13). The bi-stochastic matrix which satisfies (4.13)

is given in the following form;

Tmn(j′H , j′L|jH , jL) := δj′H ,jL1+(jH2−1)dmn δj′

L,(jH1−1)dn−mn+jL2 , (4.26)

jH2 := ⌈jHd−mn⌉, (4.27)

jH1 := jH − (jH2 − 1)dmn (4.28)

jL2 := ⌈jLd−n+mn⌉, (4.29)

jL1 := jL − (jL2 − 1)dn−mn , (4.30)

where mn is a natural number. As we will show below, Tmn satisfies (4.13) when mn =

⌊βHnqn+

n2 q2n

2nσ2(βH )

log d

⌋.

Asymptotic expansion of η(Tmn) In order to show the fact that Tmn satisfies (4.13), we firstly show that

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the following equality holds;

η(Tmn) =(

1 − βH

βL

)−

D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

)βLQH,n

, (4.31)

where

D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) :=∑

jH ,jL

PBHBL

fin (jH , jL) logPBHBL

fin (jH , jL)

pn↓G,βH

(jH)pn↓G,βL

(jL)(4.32)

η(Tmn) :=Wext

QH,n(4.33)

Wext :=∑

jH ,jL

(PBHBL

fin (jH , jL) − pn↓G,βH

(jH)pn↓G,βL

(jL))(hH(jH) + hL(jL)) (4.34)

QH,n :=∑jH

(PBH

fin (jH) − pn↓G,βH

(jH))hH(jH) (4.35)

PBHBL

fin (jH , jL) :=∑

iH ,iL

Tmn(jH , jL|iH , iL)pn↓G,βH

(iH)pn↓G,βL

(iL) (4.36)

PBH

fin (jH) :=∑jL

PBHBL

fin (jH , jL). (4.37)

The equality (4.31) is given as a special case of (4.23). Because of (4.31), the fact that Tmn satisfies (4.13)

will be shown via the asymptotic expansion of the relative entropy D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) and the extracted

heat QH,n for Tmn . For the asymptotic expansions of D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) and QH,n, we first approximate

D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) and QH,n with the relative entropies DBHand DBL

:

D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) = DBH (mn) + DBH (mn) + O(e−nα1) (4.38)

βHQH,n = mn log d − DBH(mn) + O(e−nα2) (4.39)

holds for proper real numbers α1 > 0 and α2 > 0, where

DBH (mn) :=dn∑

j=1

pn↓βH

(j) logpn↓

βH(j)

d−mnpn↓βH

(⌈jd−mn⌉)(4.40)

DBL(mn) :=

dn∑j=1

pn↓βL

(j) logpn↓

βL(j)

dmnpn↓βL

(⌈jdmn⌉)(4.41)

where ⌈x⌉ is the ceiling function of x. We can calculate DBH(mn) and DBH

(mn) + DBL(mn) with using the

strong large deviation theory [46,47] as follows;

DBH (mn) =(mn log d)2

n2β2Hσ2(βH)

+ O(m3

n

n2), (4.42)

DBH (mn) + DBL(mn) = c(1)βH ,βL

Q2H,n

n− c

(2)βH ,βL

Q3H,n

n2+ d

(1)βH ,βL

Q2H,n

n2+ O

(Q3

H,n

n5/2

)+ O

(Q4

H,n

n3

).(4.43)

Then, we obtain (4.13) combining (4.31), (4.38), (4.39), (4.42) and (4.43). Note that if we can directly calculate

DBH(mn) and DBL

(mn) precisely, we can obtain an extremely precise approximation of η(n)(Tmn) whose error

is in the order of O(e−n(α1+α2)). Thus, we obtain the precise values of DBH(mn) and DBL

(mn) by numerous

calculation, and plot the extremely precise approximation of η(n)(Tmn) as the balck dots of Fig. 3.

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General method for asymptotic expansion of η(Tmn): In the derivation of (4.42) and (4.43), we need

a high-order asymptotic analysis which have never been used in quantum information. Let us a random variable

ZX := log pn↓G,βX

(j) + nS(βX) (X=H or L), where j is a random variable on the natural numbers {j}dn

j=1 that

takes the value j with the probability pn↓G,βH

(j). We also define the functions FX(a) and the random variables

∆XZX as

FX(a) := PC [ZX ≥ a] (4.44)

FH(ZH + ∆HZH)dmn = FH(ZH), (4.45)

FL(ZL)dmn = FL(ZL − ∆L(ZL)), (4.46)

where PC is the counting measure. Then, by definition, the following two equalities hold:

DBH (mn) = Ej [mn log d −√

n∆HZH ] (4.47)

DBL(mn) = Ej [−mn log d +

√n∆LZL], (4.48)

where Ej [...] is the expectation value with j. Thus, we only have to derive Ej [∆XZX ]. We calculate Ej [∆XZX ]

by the following three steps. First, we expand log FX(a) asymptotically by using strong large deviation theory

[46, 47]. Second, we solve (4.136) and (4.137) with using the asymptotic expansion of log FX(a), and obtain

the asymptotic expansion of ∆XZZ within 1/√

n, βX and ZX . Finally, we obtain the asymptotic expansion of

Ej [∆XZX ] by calculating Ej [ZX ]. In the the section 4.2 materials, we calculate the asymptotic expansion of

η(n)(Tmn) up to the order of QH,n/n2 by the above method. However, note that our method is available to

calculate the more high orders. With our methods, we can calculate η(n)(Tmn) with arbitrary accuracy.

4.2.2 Abbrebiations

Hereafter, we will use the following abbreviations for the simplicity:

ρS = trBHBL[ρ], ρBH = trSBL

[ρ], ρBL = trSBH[ρ], ρBHBL = trS [ρ], (4.49)

where ρ is an arbitrary state of the whole system SBHBL. As in section 2.1, we will use

−βHHBH− tr[exp(−βHHBH

)] = log ρBH

ini , (4.50)

−βLHBL − tr[exp(−βLHBL)] = log ρBL

ini . (4.51)

4.2.3 Derivation of the general upper bound

In the present section, we prove Theorem 4;

Theorem 6 (General upper bound for efficiency). When an n-particle thermodynamic operation {Ej , wj} has

a constant endothermic energy amount QH , the efficiency η(n)({Ej , wj}) is bounded as follows;

η(n)({Ej , wj}) ≤(

1 − βH

βL

)−

n(D(ρG,βH(1+s)||ρG,βH ) + D(ρG,βL(1−t)||ρG,βL))βLQH

(4.52)

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where the real numbers s and t determined by

−tr[ρG,βH(1+s) log ρG,βH

]= S(βH) − βHQH

n, (4.53)

S(βH(1 + s)) + S(βL(1 − t)) = S(βH) + S(βL). (4.54)

Proof of Theorem 4 To derive the upper bound (4.52), we employ the following expression of the efficiencies

η(n)({Ej , wj}):

η(n)({Ej , wj}) ≤(

1 − βH

βL

)− D(ρfin||ρini)

βLQH,n({Ej , wj}), (4.55)

which can derived from the relation S(ρini) ≤ S(ρfin) by the method in Ref. [8], which is introduced in section

2.1, as follows. Using the relation S(ρini) ≤ S(ρfin), we have

−D(ρfin∥ρini) ≥ −tr[(ρini − ρfin) log ρini](a)= −tr[(ρBH

ini − ρBH

fin ) log ρBH

ini ] − tr[(ρBL

ini − ρBL

fin ) log ρBL

ini ] − tr[(ρSini − ρS

fin) log ρSini]

(b)= βHtr[(ρBH

ini − ρBH

fin )HBH ] + βLtr[(ρBL

ini − ρBL

fin )HBL ] + βLtr[(ρSini − ρS

fin)HS ]

= (βL + (βH − βL))tr[(ρBH

ini − ρBH

fin )HBH] + βLtr[(ρBL

ini − ρBL

fin )HBL] + βLtr[(ρS

ini − ρSfin)HS ]

(c)= (βH − βL)QH,n({Ej , wj}) + βLW

(n)ext ({Ej , wj}), (4.56)

where (a) follows from ρini = ρSini ⊗ ρBH

ini ⊗ ρBL

ini , (b) follows from (4.50), (4.51) and ρSini = ρS

fin, (c) follows from

(4.4) and (4.5). Therefore, we obtain (4.55) as

η(n)({Ej , wj}) =W

(n)ext ({Ej , wj})

QH,n({Ej , wj})≤

(1 − βH

βL

)− D(ρfin||ρini)

βLQH,n({Ej , wj}). (4.57)

Hence, it is sufficient to prove the inequality

D(ρfin||ρini) ≥ n(D(ρG,βH(1+s)||ρG,βH ) + D(ρG,βL(1−t)||ρG,βL)

)(4.58)

for any n-particle thermodynamic operation satisfying the constraint QH,n({Ej , wj}) = QH . Because of (4.50),

the endothermic energy amount QH,n({Ej , wj}) is written as

QH,n({Ej , wj}) = tr[HBH(ρBH

ini − ρBH

fin )] = − 1βH

tr[(ρBH

ini − ρBH

fin ) log ρBH

ini ] =1

βH

(S(ρBH

ini ) + tr[ρBH

fin log ρBH

ini ])

=1

βH

(S(ρBH

ini ) − S(ρBH

fin ) + S(ρBH

fin ) + tr[ρBH

fin log ρBH

ini ])

=1

βH

(S(ρBH

ini ) − S(ρBH

fin ) − D(ρBH

fin ∥ρBH

ini ))

. (4.59)

Thus, the constraint QH,n({Ej , wj}) = QH is equivalent to QH = 1βH

(S(ρBH

ini ) − S(ρBH

fin ) − D(ρBH

fin ∥ρBH

ini )).

Because every n-particle thermodynamic operation is a unital operation, it preserves or increases the entropy of

the whole system. Under such entropy-increasing transformations, the relative entropy D(ρfin∥ρini) is bounded

by the following lemma, and thus (4.52) holds for any thermodynamic operation. ¤

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Lemma 9. For an arbitrary real number QH ,

minρ

{D(ρ∥ρini)

∣∣S(ρ) ≥ S(ρini), βHQH = S(ρBH

ini ) − S(ρBH ) − D(ρBH∥ρBH

ini ), ρSini = ρS

}= n

(D(ρG,βH(1+s)||ρG,βH

) + D(ρG,βL(1−t)||ρG,βL))

(4.60)

holds, where the real numbers s and t determined by (4.53) and (4.54).

To show Lemma 1, we prepare the following lemma:

Lemma 10. For a given state ρ and a real number C > 0,

minρ′:S(ρ′)≥C

−tr[ρ′ log ρ] = −tr[

ρ1−x

tr[ρ1−x]log ρ

], (4.61)

where x is a real number satisfying that

S

(ρ1−x

tr[ρ1−x]

)= C (4.62)

Proof of Lemma 2:

tr[

ρ1−x

tr[ρ1−x]log ρ

]− tr[ρ′ log ρ] = tr

[(ρ1−x

tr[ρ1−x]− ρ′

)log ρ

]=

11 − x

tr[(

ρ1−x

tr[ρ1−x]− ρ′

)log

ρ1−x

tr[ρ1−x]

]=

11 − x

(−S(

ρ1−x

tr[ρ1−x]) + S(ρ′) + D

(ρ′

∥∥ ρ1−x

tr[ρ1−x]

))=

11 − x

(S(ρ′) − C + D

(ρ′

∥∥ ρ1−x

tr[ρ1−x]

))≥ 0. (4.63)

The equality is valid only when S(ρ′) = C and ρ′ = ρ1−x

tr[ρ1−x] hold. ¤

Proof of Lemma 1: Firstly, we point out that the ρmin := ρ⊗nG,βH(1+s) ⊗ ρS

ini ⊗ ρ⊗nG,βL(1−t) satisfies the

conditions S(ρ) ≥ S(ρini), βHQH = S(ρBH

ini ) − S(ρBH

fin ) − D(ρBH∥ρBH

ini ) and ρSini = ρS , and satisfies

D(ρmin∥ρBHBL

ini ) = n(D(ρG,βH(1+s)||ρG,βH

) + D(ρG,βL(1−t)||ρG,βL)). (4.64)

Thus, we only have to prove

minρ

{D(ρ∥ρini)

∣∣S(ρ) ≥ S(ρini), βHQH = S(ρBH

ini ) − S(ρBH ) − D(ρBH∥ρBH

ini ), ρSini = ρS

}≤ n

(D(ρG,βH(1+s)||ρG,βH ) + D(ρG,βL(1−t)||ρG,βL)

). (4.65)

Under the given constraints, we can convert D(ρ∥ρini) as follows;

D(ρ∥ρini)(a)= −S(ρ) − tr[ρS log ρS

ini] − tr[ρBH log ρBH

ini ] − tr[ρBL log ρBL

ini ](b)

≤ −S(ρBH

ini ) − S(ρBL

ini ) − tr[ρBH log ρBH

ini ] − tr[ρBL log ρBL

ini ] (4.66)

= −S(ρBL

ini ) − S(ρBH

ini ) + D(ρBH∥ρBH

ini ) + S(ρBH

ini ) − tr[ρBL log ρBL

ini ](c)= −S(ρBL

ini ) − βHQH − tr[ρBL log ρBL

ini ] (4.67)(d)= n

(D(ρG,βH(1+s)||ρG,βH ) + D(ρG,βL(1−t)||ρG,βL)

)+tr[ρ⊗n

G,βL(1−t) log ρBL

ini ] − tr[ρBL log ρBL

ini ] (4.68)

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where (a) follows from ρini = ρSini ⊗ ρBH

ini ⊗ ρBL

ini , (b) follows from S(ρini) ≤ S(ρ) and ρSini = ρS , (c) follows from

βHQH = S(ρBH

ini ) − S(ρBH ) − D(ρBH∥ρBH

ini ), (d) follows from (4.53) and (4.54) Thus, in order to prove Lemma

9, it is sufficient to show

tr[ρ⊗nG,βL(1−t) log ρBL

ini ] ≤ tr[ρBL log ρBL

ini ] (4.69)

under the given constraints. As we will show below, the given constraints yield the following inequality:

S(ρBL) ≥ S

((ρBL

ini )(1−t)

tr[(ρBL

ini )(1−t)]

). (4.70)

Hence, by substituting ρBL and S

((ρ

BLini )(1−t)

tr[(ρBLini )(1−t)]

)for ρ′ and C of Lemma 2, (4.70) guarantees (4.69)

Finally, let us prove (4.70). We have

S(ρBH ) − S

((ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

)

= −tr[ρBH log ρBH ] + tr

[(ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]log

(ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

]

= −tr[ρBH log ρBH ] + tr

[ρBH log

(ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

]+ tr

[((ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]− ρBH

)log

(ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

]

= −D

(ρBH

∥∥ (ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

)+ tr

[((ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]− ρBH

)log

(ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

]

= −D

(ρBH

∥∥ (ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

)+ (1 + s)tr

[((ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]− ρBH

)log ρBH

ini

](4.71)

= −D

(ρBH

∥∥ (ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

)+ (1 + s)(−nS(βH) + βHQH + S(ρBH

ini ) − βHQH) (4.72)

= −D

(ρBH

∥∥ (ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

)≤ 0, (4.73)

where we use (4.53) and the relation S(ρBH

ini ) + trρBH log ρBH

ini = βHQH given from (4.59) to convert (4.71) into

(4.72). The subadditivity of the von Neumann entropy, S(ρini) ≤ S(ρ) and ρSini = ρS imply

S(ρBH ) + S(ρBL) ≥ S(ρBH

ini ) + S(ρBL

ini ). (4.74)

Thus, the combination of (4.54), (4.73), and (4.74) derives (4.70) as follows:

S(ρBL) ≥ −S(ρBH ) + S(ρBH

ini ) + S(ρBL

ini ) ≥ −S

((ρBH

ini )(1+s)

tr[(ρBH

ini )(1+s)]

)+ S(ρBH

ini ) + S(ρBL

ini ) = S

((ρBL

ini )(1−t)

tr[(ρBL

ini )(1−t)]

),

(4.75)

where s and t are defined in (4.53) and (4.54). ¤

4.2.4 Relation with cumulant generating function

In the subsection 4.2.3, we have derived a general upper bound (4.7). Next, we asymptotically expand it, and

gives (4.10). In the present subsection, we prepare for the derivation of the asymptotic expansion.

Let us introduce the cumulant generating functions φX(1 + s) := log trρ1+sG,βX

for X = H,L. Then, the

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variance and the skewness of energy

σ2(βX) := tr[ρβX (HBX − tr[ρβX HBX ])2] (4.76)

γ1(βX) :=tr[ρβX

(HBX− tr[ρβX

HBX])3]

σ3(β)(4.77)

satisfies

φ′′X(1) = β2

Xσ2(βX) (4.78)

φ′′′X(1) = β3

Xγ1(βX)σ3(βX). (4.79)

Note that the Fisher information of the family {ρG,βX(1+s)}s is φ′′X(1 + s) [59]. The relative entropy and the

entropy are written as [59]

D(ρG,βX(1+s)∥ρG,βX) = φ′

X(1 + s)s − φX(1 + s) (4.80)

S(βX(1 + s)) = −(1 + s)φ′X(1 + s) + φX(1 + s) = −φ′

X(1 + s) − D(ρG,βX(1+s)∥ρG,βX). (4.81)

Since φX is strictly convex, we can define the inverse function of φ′X , which is denoted by ψX . In the following,

we focus on the entropy S(βX), which is denoted by SX . Then, we have

ψ′X(−SX) = φ′′

X(1)−1 =1

β2Xσ2(βX)

(4.82)

ψ′′X(−SX) = −φ′′′

X(1)φ′′X(1)−3 = − γ1(βX)

β3Xσ3(βX)

. (4.83)

When s is close to 0, A := φ′X(1 + s) is also close to −SX . Hence,

D(ρG,βX(1+s)∥ρG,βX ) =φ′X(1 + s) − φX(1 + s) = φ′

X(1 + s)(ψX(A) − 1) − φX(ψX(A))

=(ψX(−SX) − 1)(A + SX) +12ψ′

X(−SX)(A + SX)2 +16ψ′′

X(−SX)(A + SX)3 + O((A + SX)4)

=12ψ′

X(−SX)(A + SX)2 +16ψ′′

X(−SX)(A + SX)3 + O((A + SX)4). (4.84)

Then, the entropy is characterized as

S(βX(1 + s)) = −φ′X(1 + s) − D(ρG,βX(1+s)∥ρG,βX

) = −A − 12ψ′

X(−SX)(A + SX)2 + O((A + SX)3). (4.85)

Thus, ∆XS := S(βX(1 + s)) − SX satisfies

∆XS = −(A + SX) − 12ψ′

X(−SX)(A + SX)2 + O((A + SX)3), (4.86)

which implies

−(A + SX) = ∆XS +12ψ′

X(−SX)(∆XS)2 + O((∆XS)3). (4.87)

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Thus,

D(ρG,βX(1+s)∥ρG,βX ) =12ψ′

X(−SX)(∆XS)2 + (12ψ′

X(−SX)2 − 16ψ′′

X(−SX))(∆XS)3 + O((∆XS)4)

=1

2β2Xσ2(βX)

(∆XS)2 + (1

2β4Xσ4(βX)

+γ1(βX)

6β3Xσ3(βX)

)(∆XS)3 + O((∆XS)4). (4.88)

This relation will be used in the following sections.

4.2.5 Taylor expansion of the general upper bound

Now, we have completed the preparation. Hereafter, we derive the asymptotic expansion (4.10) in the present

section, and prove that the classical work extraction Tmn satisfies (4.13) when mn =

⌊βHnqn+

n2 q2n

2nσ2(βH )

log d

⌋in the

next subsection 4.2.6. Namely, in the present subsection and the next subsection 4.2.6, we prove the extended

Carnot’s Theorem. For the convenience to read, we write down the theorem again;

Theorem 7 (Extended Carnot’s Theorem). When n-particle thermodynamic operations {{Ej , wj}}∞n=1 have

extracted heats {QH,n}∞n=1 satisfying limn→∞ QH,n/n = 0, the upper bound (4.7) has an asymptotic expansion

as follows:

η(n)({Ej , wj}) ≤(

1 − βH

βL

)−

∞∑k=1

c(k)βH

qkn, (4.89)

where qn := QH,n/n and

c(1)βH ,βL

:=(

12β2

Hσ2(βH)+

12β2

Lσ2(βL)

)β2

H

βL(4.90)

c(2)βH ,βL

:=(− γ1(βH)

6β3Hσ3(βH)

+γ1(βL)

6β3Lσ3(βL)

+1

2β4Lσ4(βL)

+1

2β2Hβ2

Lσ2(βH)σ2(βL)

)β3

H

βL. (4.91)

On the other hand, for an arbitrary sequence of real numbers {qn} which satisfy qn → 0 at the limit n → ∞, we

can take the n-particle thermodynamic operations {Ej , wj} whose extracted heats {QH,n} satisfy qn

qn:= QH,n

nqn→ 1

at the limit n → ∞ and

η(n)({Ej , wj}) =(

1 − βH

βL

)− c

(1)βH ,βL

qn − c(2)βH ,βL

q2n − d

(1)βH ,βL

qn

n+ O

(q2n√n

)+ O

(q3n

), (4.92)

where

d(1)βH ,βL

:=(

(γ1(βH)

2βHσ(βH)+

1β2

Hσ2(βH))2 + (

γ1(βL)2βLσ(βL)

+1

β2Lσ2(βL)

)2)

β2H

βL. (4.93)

In the present subsection, we will derive (4.89).

Proof of (4.89): To show (4.89), we employ the notation given in Section 4.2.4. Now, we choose s and t

satisfying (4.53) and (4.54). We choose ∆HS and ∆LS as ∆HS := S(βH(1 + s)) − SH and ∆LS := S(βL(1 −

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t)) − SL. Thus, the relations (4.53), (4.88), and (4.54) yield that

−βHQH

n= ∆HS + D(ρG,βHs∥ρG,βH ) = ∆HS +

12β2

Hσ2(βH)(∆HS)2 + O((∆HS)3) (4.94)

∆LS = −∆HS. (4.95)

Thus,

∆HS = −βHQH

n− 1

2β2Hσ2(βH)

(βHQH

n)2 + O((

βHQH

n)3), (4.96)

which implies that

∆HS2 =(βHQH

n)2 +

1β2

Hσ2(βH)(βHQH

n)3 + O((

βHQH

n)4) (4.97)

∆HS3 = − (βHQH

n)3 + O((

βHQH

n)4. (4.98)

Therefore,

n(D(ρG,βH(1+s)||ρG,βH) + D(ρG,βL(1−t)||ρG,βL

))

=1

2β2Hσ2(βH)

(∆HS)2 + (1

2β4Hσ4(βH)

+γ1(βH)

6β3Hσ3(βH)

)(∆HS)3

+1

2β2Lσ2(βL)

(∆LS)2 + (1

2β4Lσ4(βL)

+γ1(βL)

6β3Lσ3(βL)

)(∆LS)3 + O((∆HS)4)

=(1

2β2Hσ2(βH)

+1

2β2Lσ2(βL)

)(∆HS)2 + (1

2β4Hσ4(βH)

− 12β4

Lσ4(βL)+

γ1(βH)6β3

Hσ3(βH)− γ1(βL)

6β3Lσ3(βL)

)(∆HS)3 + O((∆HS)4)

=(1

2β2Hσ2(βH)

+1

2β2Lσ2(βL)

)(βHQH

n)2

+ (− γ1(βH)6β3

Hσ3(βH)+

γ1(βL)6β3

Lσ3(βL)+

12β2

Hβ2Lσ2(βH)σ2(βL)

+1

2β4Lσ4(βL)

)(βHQH

n)3 + O((∆HS)4). (4.99)

Therefore, substituting (4.99) into (4.52), we obtain (4.89).

4.2.6 Asymptotic expansion of efficiency η(n)(Tmn)

Here, we prove that η(n)(Tmn) satisfies (4.92), when mn =

⌊βHnqn+

n2 q2n

2nσ2(βH )

log d

⌋. This is the final part of the proof

of Refined Carnot’s Theorem. We first derive (4.31), and second derive (4.38) and (4.39), and finally prove

(4.42) and (4.43).

4.2.6.1 Derivation of (4.31)

Let us derive (4.31). Because of the definition of the bi-stochasitic matrix Tmn(j′H , j′L|jH , jL), it preserves the

entropy; S(PBHBL

fin ) = S(pn↓G,βH

pn↓G,βL

). Similarly as (4.23), using the relation S(PBHBL

fin ) = S(pn↓G,βH

pn↓G,βL

), we

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have

−D(PBHBL

fin ∥pn↓G,βH

pn↓G,βL

) = −∑

jH ,jL

[(pn↓G,βH

(jH)pn↓G,βL

(jL) − PBH ,BL

fin (jH , jL)) log pn↓G,βH

(jH)pn↓G,βL

(jL)]

= −∑jH

[(pn↓G,βH

(jH) − PBH

fin (jH)) log pn↓G,βH

(jH)] −∑jL

[(pn↓G,βL

(jL) − PBL

fin (jL)) log pn↓G,βL

(jL)]

= βH

∑jH

[(pn↓G,βH

(jH) − PBH

fin (jH))hH(jH)] + βL

∑jL

[(pn↓G,βL

(jL) − PBL

fin (jL))hL(jL)]

= (βL + (βH − βL))∑jH

[(pn↓G,βH

(jH) − PBH

fin (jH))hH(jH)] + βL

∑jL

[(pn↓G,βL

(jL) − PBL

fin (jL))hL(jL)]

= (βH − βL)QH,n + βLW(n)ext . (4.100)

Therefore, we obtain (4.31) as

η(n)(Tmn) =W

(n)ext

QH,n=

(1 − βH

βL

)−

D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

)βLQH,n

. (4.101)

¤

Due to (4.31), in order to obtain the asymptotic expansion of η(n)(Tmn), it is enough to asymptotically

expand the relative entropy D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) and the endothermic amount QH,n.

4.2.6.2 Approximations of D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) and QH,n

Let us prove (4.38) and (4.39). As a preparation for the proof, we introduce the probabilities PBH

fin (jH) and

PBL

fin (jL), whose product PBH

fin (jH)PBL

fin (jL) approximates the final distribution PBHBL

fin (jH , jL):

PBH

fin (jH) := dmnpn↓G,βH

(jH2dmn)δjH1,1, (4.102)

PBL

fin (jL) := d−mnpn↓G,βL

(jL2), (4.103)

where jH1, jH2 and jL2 are defined as (4.28), (4.27) and (4.29).

First of all, let us show that the probability PBH

fin PBL

fin approximates the true probability PBHBL

fin .

Lemma 11. When a sequence {mn} satisfies

mn < n

(min

{1 − S(pG,βL

)log d

, −log maxj{pβH (j)}d

j=1

log d

}− ϵ

)(4.104)

with a small ϵ > 0, the following inequality satisfies;

∥PBHBL

fin − PBH

fin PBL

fin ∥1 = O(e−nα1), (4.105)

where ∥P − Q∥1 :=∑

j |P (j) − Q(j)|.

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Proof: We have

∥PBHBL

fin − PBH

fin PBL

fin ∥1 (4.106)

=

∣∣∣∣∣∣∑

jH1,jH2,jL1,jL2

pn↓βH

(jL1 + (jH2 − 1)dmn)pn↓βL

(jL2 + (jH1 − 1)dn−mn) − pn↓βH

(jH2dmn)pn↓

βL(jL2)δ1,jH1

∣∣∣∣∣∣=

∑jH2,jL1,jL2

(pn↓

βH(jL1 + (jH2 − 1)dmn)pn↓

βL(jL2) − pn↓

βH(jH2d

mn)pn↓βL

(jL2))

(4.107)

+dmn∑

jH1=2

∑jH2,jL1,jL2

pn↓βH

(jL1 + (jH2 − 1)dmn)pn↓βL

(jL2 + (jH1 − 1)dn−mn) (4.108)

≤dn−mn∑jH2=1

dmn∑jL1=1

(pn↓

βH(jL1 + (jH2 − 1)dmn) − pn↓

βH(jH2d

mn))

+dn∑

j=1

dn∑j′=dn−mn+1

pn↓βH

(j)pn↓βL

(j′) (4.109)

=dn∑

j′=dn−mn+1

pn↓βL

(j′) +dmn∑i=1

dn−mn∑j=1

(pn↓

βH(i + (j − 1)dmn) − pn↓

βH(jdmn)

). (4.110)

Since the distribution pn↓βL

takes the value from j = 1 to j = en(S(pβL)+ϵ) except for exponentially small

probability, the probability∑dn

j=dn−mn+1 pn↓βL

(j) goes to zero exponentially when mn < n((1 − S(ρG,βL)

log d ) − ϵ).

Although the distribution pn↓βH

has dn events, the probabilities pn↓βH

(k) take at most (n+1)d−1 distinct values

due to the combinatorics. That is, when we fix the value of i, pn↓βH

(i + dmn(j − 1)) − pn↓βH

(dmnj) takes non-zero

values for at most (n + 1)d−1 elements for j. Therefore,

dmn∑i=1

dn−mn∑j=1

(pn↓βH

(i + dmn(j − 1)) − pn↓βH

(dmnj)) ≤ dmn(n + 1)d−1pn↓βH

(1) = dmn(n + 1)d−1(maxi

pβH(i))n,

(4.111)

which goes to zero exponentially in the case of mn < −n

(log maxj{pβH

(j)}dj=1

log d + ϵ

). Thus, when (4.104) holds,

the equation (4.105) is valid. ¤

Now, we have complteted the preparation for the calculation of (4.38) and (4.39). Let us calculate them.

Lemma 12. When PBHBL

fin satisfies PBHBL

fin (jH , jL) =∑

j′H ,j′

LTmn(jH , jL|j′H , j′L)pn↓

G,βH(j′H)pn↓

G,βL(j′L) and the

sequence {mn} satisfies (4.104),

D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) = DBH (mn) + DBH (mn) + O(e−nα2) (4.112)

βHQH,n(Vn(mn)) = mn log d − DBH(mn) + O(e−nα3) (4.113)

hold with real constants α2 > 0 and α3 > 0, where

DBH(mn) :=

dn∑j=1

pn↓βH

(j) logdmnpn↓

βH(j)

pn↓βH

(⌈d−mnj⌉)(4.114)

DBL(mn) :=

dn∑j=1

pn↓βH

(j) logpn↓

βH(j)

dmnpn↓βH

(dmnj), (4.115)

where ⌈x⌉ is the ceiling function of x.

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Proof: First, we define

DBH (mn) :=:= D(PBH

fin ∥pn↓G,βH

) (4.116)

=dn∑

j=1

PBH

fin (j) logPBH

fin (j)

pn↓G,βH

(j)(4.117)

=dn−mn∑j′=1

dmnpn↓βH

(dmnj′) logdmnpn↓

βH(dmnj′)

pn↓βH

(j′)

=dn∑

j=1

pn↓βH

(dmn⌈d−mnj⌉) logdmnpn↓

βH(dmn⌈d−mnj⌉)

pn↓βH

(⌈d−mnj⌉). (4.118)

Since∑dmn

j=1 |pn↓βH

(dmn⌈d−mnj⌉)−pn↓βH

(j)| is exponentially small and the difference between logdmnpn↓

βH(dmn⌈d−mn j⌉)

pn↓βH

(⌈d−mn j⌉)

and logdmnpn↓

βH(j)

pn↓βH

(⌈d−mn j⌉)is linear with respect to n at most, the difference DBH

(mn) − DBH(mn) is exponentially

small. Similarly, we define

DBL(mn) := D(PBL

fin ∥pn↓G,βL

). (4.119)

Then, the difference DBL(mn)−DBL(mn) is exponentially small. Therefore, it is sufficient for (4.114) to show

that

D(PBHBL

fin ∥pn↓G,βH

pn↓G,βL

) = DBH(mn) + DBH

(mn) + O(e−nα2). (4.120)

Using Lemma 11, we show (4.112) as follows. Because of Fannes’s theorem [60], the equation S(PBHBL

fin ) −S(PBH

P ⊗ PBL

fin ) = O(ne−nα1) follows from (4.105). Here, remember that the operator norm ∥Y ∥ of Y satisfies

the inequality tr[XY ] ≤ ∥X∥1∥Y ∥. Then, the maximum Emax of the eigenvalues of HB satisfies the inequality

|∑

jH ,jL[(PBH

fin (jH)PBL

fin (jL) − PBHBL

fin (jH , jL)) log PBHBL

ini (jH , jL)]| ≤ 2n∥PBH

fin PBL

fin − PBHBL

fin ∥1βLEmax. Thus,

D(PBH

fin ⊗PBL

fin ||pn↓G,βH

pn↓G,βL

)−D(PBHBL

fin ||pn↓G,βH

pn↓G,βL

) = S(PBHBL

fin )−S(PBH

fin PBL

fin )+∑

jH ,jL[(PBH

fin (jH)PBL

fin (jL)−PBHBL

fin (jH , jL)) log pn↓G,βH

(jH)pn↓G,βL

(jL)] = O(ne−nα1) implies (4.120), which implies (4.112).

Next, we will show (4.113). We deformate βHQH,n − mn log d − DBH(mn) as follows;

βHQH,n − mn log d + DBH (mn) = S(PBH

fin ) − S(PBH

fin ) +∑

jH ,jL

[(PBH

fin (jH) − PBL

fin (jL)) log pn↓G,βH

(jH)]. (4.121)

Therefore, similar to (4.120), we find that βHQH,n − mn log d − DBH(mn) is exponentially small. Since the

difference DBH (mn) − DBH (mn) is also exponentially small, We obtain (4.113). ¤

4.2.6.2 Calculation of DBH(mn) and DBL

(mn)

In the present subsubsection, we will prove the following lemma, which gives the concrete values of DBH(mn)

and DBL(mn). In the proof of the following lemma, we will use the asymptotic expansions of − log pn↓G,βH

(j)

and log j by using the strong large deviation theory by Bahadur and Rao [46, 47]. We will also see that the

difference of the fourth constant order terms in the asymptotic expansions generates the second order term of

(4.92).

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Lemma 13. When mn = o(n),

DBH (mn) =(mn log d)2n−1 ψ′H(−SH)

2+ (mn log d)3n−2(

ψ′′H(−SH)

6− ψ′

H(−SH)2

2)

+ (mn log d)2n−2(ψ′′

H(−SH)2ψ′

H(−SH)− ψ′

H(−SH))2 + O(m3nn−5/2) + O(m4

nn−3), . (4.122)

DBL(mn) =(mn log d)2n−1 ψ′

L(−SL)2

+ (mn log d)3n−2(−ψ′′L(−SL)

6+

ψ′L(−SL)2

2)

+ (mn log d)2n−2(ψ′′

L(−SL)2ψ′

L(−SL)− ψ′

L(−SL))2 + O(m3nn−5/2) + O(m4

nn−3) (4.123)

Firstly, let us prove (4.92) by using Lemma 12 and Lemma 13.

Proof of (4.92): To show (4.92), we choose

mn =

⌊βHQH,n + ψ′

H(−SH)2n β2

HQ2H,n

log d

⌋. (4.124)

Then,

QH,n(Tmn) = QH,n(Vn(mn))(a)=

mn log d

βH− DBH (mn)

βH+ O(e−nα3)

(b)=

mn log d

βH− (mn log d)2n−1 ψ′

H(−SH)2βH

+ O(m3

n

n2)

(c)= QH,n +

βHQ2H,nψ′

H(βH)2n

−βHQ2

H,nψ′H(βH)

2n+ O(

Q3H,n

n2) + o(1) = QH,n + O(

Q3H,n

n2) + o(1),

(4.125)

where (a), (b), and (c) follow from (4.113), (4.122), and (4.124), respectively.

Substituting the relation (4.124) into (4.122) and (4.123), we have

DBH(mn) =(βHQH,n)2n−1 ψ′

H(−SH)2

+ (βHQH,n)3n−2 ψ′′H(−SH)

6+ (mn log d)2n−2(

ψ′′H(−SH)

2ψ′H(−SH)

− ψ′H(−SH))2

+ O(Q3H,nn−5/2) + O(Q4

H,nn−3), (4.126)

DBL(mn) =(βHQH,n)2n−1 ψ′

L(−SL)2

+ (βHQH,n)3n−2(−ψ′′L(−SL)

6+

ψ′H(−SH)ψ′

L(−SL)2

+ψ′

L(−SL)2

2)

+ (βHQH,n)2n−2(ψ′′

L(−SL)2ψ′

L(−SL)− ψ′

L(−SL))2 + O(Q3H,nn−5/2) + O(Q4

H,nn−3). (4.127)

Therefore, (4.82) and (4.83) imply that

DBH(mn) + DBL

(mn) =c(1)βH ,βL

(βHQH,n)2n−1 + c(2)βH ,βL

(βHQH,n)3n−2 + d(1)βH ,βL

(βHQH,n)2n−2

+ O(Q3H,nn−5/2) + O(Q4

H,nn−3). (4.128)

Combining (4.57) and (4.128), we obtain the evaluation (4.92) for the efficiency η(n)(Tmn). ¤Finally, let us prove Lemma 13.

Proof of Lemma 5: We focus on the logarithmic likelihood of pn,↓G,βX

, which can be regarded as the the

logarithmic likelihood ratio between the distribution pnG,βX

and the counting measure PC . Now, we define the

random variable ZX := (log pn,↓G,βX

(j) + nSX)/√

n, where j is a random variable on the natural numbers {j}dn

j=1

that takes the value j with the probability pn↓G,βH

(j). Then, when j = PC{ZX ≥ a}, j is the maximum integer

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satisfying log pn,↓G,βX

(j) ≥ −nSX +√

na. We have the relations

E[ZX ] = 0 (4.129)

E[Z2X ] = φ′′

X(1) =1

ψ′X(−SX)

(4.130)

E[Z3X ] =

φ′′′X(1)√

n= − ψ′′

X(−SX)ψ′

X(−SX)3√

n, (4.131)

E[Z4X ] = 3φ′′

X(1)2 +φ′′′′

X (1)n

=3

ψ′X(−SX)2

+ (− ψ′′′X (−SX)

ψ′X(−SX)3

+ 3ψ′′

X(−SX)2

ψ′X(−SX)5

)1n

, (4.132)

where E is the expectation under the distribution pn,↓G,βX

.

Next, we focus on the Legendre transform of φX , which is written as

maxs

sR − φX(s) = ψX(R)R − φX(ψX(R)). (4.133)

We employ the strong large deviation by Bahadur and Rao [46,47]:

log PC{log pn,↓G,βX

(j) ≥ nR}

= − n(ψX(R)R − φX(ψX(R))) − log(√

2πnφ′′X(ψX(R))ψX(R))

+1

nφ′′(ψX(R))(− 5φ′′′(ψX(R))2

24φ′′(ψX(R))2+

φ′′′′(ψX(R))8φ′′(ψX(R))

− φ′′′(ψX(R))2ψX(R)φ′′(ψX(R))

− 1ψX(R)2

)

+l∑

k=3

fX,k(R)n1−k + o(1

nl−1)

= − n(ψX(R)R − φX(ψX(R))) − log√

2πn − log ψX(R) +12

log ψX′(R))

+1n

[−18

ψ′′′(R)ψ′(R)2

+16

ψ′′(R)2

ψ′(R)3+

12

ψ′′(R)ψ(R)ψ′(R)

− ψ′(R)ψ(R)2

]

+l∑

k=3

fX,k(R)n1−k + o(1

nl−1), (4.134)

where fX,k(R) is a smooth function. In the following, for a unified treatment, the functions −(ψX(R)R −φX(ψX(R))), − log

√2π− log ψX(R)+ 1

2 log ψX′(R)), and −1

8ψ′′′(R)ψ′(R)2 + 1

6ψ′′(R)2

ψ′(R)3 + 12

ψ′′(R)ψ(R)ψ′(R) −

ψ′(R)ψ(R)2 are written

as fX,0(R), fX,1(R), and fX,2(R). So, (4.134) is simplified as log PC{log pn,↓G,βH

(j) ≥ nR} =∑l

k=0 fX,k(R)n1−k−12 log n + o( 1

nl−1 ).

Thus, we have

log FX(ZX) := log PC{log pn,↓G,βX

(j) ≥ −nSX +√

nZX}

=l∑

k=0

2(l−k)∑t=0

f(t)X,k(−SX)n1−k− t

2

t!Zt

X − 12

log n + o(1

nl−1). (4.135)

To show (4.122) and (4.123), we define ∆HZH and ∆LZL as

FH(ZH + ∆HZH)dmn = FH(ZH), (4.136)

FL(ZL)dmn = FL(ZL − ∆L(ZL)), (4.137)

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which are equivalent with

mn log d = log FH(ZH) − log FH(ZH + ∆HZH) (4.138)

mn log d = log FL(ZL − ∆LZL) − log FL(ZL). (4.139)

Hence, ∆HZH and ∆LZL satisfy the equations

mn log d =2l∑

i=1

αH,i(ZH)(∆HZH)i

i!+ o(n1−l) (4.140)

mn log d = −2l∑

i=1

αL,i(ZL)(−∆LZL)i

i!+ o(n1−l), (4.141)

where αX,i(ZX) := −∑l− i

2k=0

∑2(l−k)−ij=0 n1−k− i+j

2Zj

X

j! f(i+j)X,k (−SX), where f

(i)X,k is the i-th derivative of fX,k. Due

to the definition (4.136), we have

DBH(mn) =

dmn∑j=1

pn,↓G,βH

(j)(mn log d) + log pn,↓G,βH

(j) − log pn,↓G,βH

(⌈d−mnj⌉)

=E[(mn log d) + log pn,↓G,βH

(j) − log pn,↓G,βH

(⌈d−mn j⌉)]

=E[(mn log d) + (−nS +√

nZH) − (−nSH +√

n(ZH + ∆HZH))] = E[(mn log d) −√

n∆HZH ].

(4.142)

Hence, it is needed to solve the equation (4.140) with respect to ∆HZH . Notice that αX,i(ZX) = O(n1− i2 ). We

apply Lemma 14 to the equation (4.140) with x = ∆HZH√n

, ai = αX,i(ZX)ni2 , and ϵ = mn log d

n . Then, we obtain

∆HZH√n

=mn log d√nαH,1(ZH)

− αH,2(ZH)(mn log d)2√nα3

H,1(ZH)+

2αH,2(ZH)2(mn log d)3√nα5

H,1(ZH)− αH,3(ZH)(mn log d)3√

nα4H,1(ZH)

+ O(m4nn−4).

(4.143)

That is, we obtain

∆HZH =mn log d

αH,1(ZH)− αH,2(ZH)(mn log d)2

α3H,1(ZH)

+2αH,2(ZH)2(mn log d)3

α5H,1(ZH)

− αH,3(ZH)(mn log d)3

α4H,1(ZH)

+ O(m4nn−7/2).

(4.144)

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Since SH = −φ′H(1), using the relations (4.82) and (4.83), we have

f(j)X,0(R) = − ψ(j−1)(R) (4.145)

f(1)X,1(R) = − ψ′(R)

ψ(R)+

ψ′′(R)2ψ′(R)

(4.146)

f(2)X,1(R) = − ψ′′(R)ψ(R) − ψ′(R)2

ψ(R)2+

ψ′′′(R)ψ′(R) − ψ′′(R)2

2ψ′(R)2(4.147)

f(3)X,1(R) = − ψ(R)2ψ′′′(R) − 3ψ(R)ψ′(R)ψ′′(R) + 2ψ′(R)3

ψ(R)3+

ψ′(R)2ψ′′′′(R) − 3ψ′(R)ψ′′(R)ψ′′′(R) + 2ψ′′(R)3

2ψ′(R)3

(4.148)

f(1)X,2(R) = − 1

8ψ′(R)ψ′′′′(R) − 2ψ′′′(R)ψ′′(R)

ψ′(R)3+

16

2ψ′(R)ψ′′(R)ψ′′′(R) − 3ψ′′(R)3

ψ′(R)4

+12

ψ(R)ψ′(R)ψ′′′(R) − ψ′(R)2ψ′′(R) − ψ(R)ψ′′(R)2

ψ(R)2ψ′(R)2− ψ(R)ψ′′(R) − 2ψ′(R)2

ψ(R)3, (4.149)

we have

αH,1(ZH) =√

n + ψ′H(−SH)ZH +

1√n

(ψ′H(−SH) +

ψ′′H(−SH)

2(Z2

H − 1ψ′

H(−S))) +

1n

(ψ′′′

H (−SH)6

Z3H − DH,1ZH)

+1

n3/2(ψ′′′′

H (−SH)24

Z4H − DH,2

2Z2

H − DH,3) + O(n−2) (4.150)

αH,2(ZH) =ψ′

H(−SH)2

+ψ′′

H(−SH)2√

nZH +

1n

(ψ′′′

H (−SH)4

Z2H − DH,1

2) + O(n−3/2) (4.151)

αH,3(ZH) =1√n

ψ′′H(−S)

6+ O(n−1), (4.152)

where

DH,1 := − ψ′′H(−SH) + ψ′

H(−SH)2 +12

ψ′′′H (−SH)ψ′

H(−SH) − ψ′′H(−SH)2

ψ′H(−SH)2

(4.153)

DH,2 := − ψ′′′(−SH) + 3ψ′(−SH)ψ′′(−SH) − 2ψ′(−SH)3

+ψ′(−SH)2ψ′′′′(−SH) − 3ψ′(−SH)ψ′′(−SH)ψ′′′(−SH) + 2ψ′′(−SH)3

2ψ′(−SH)3(4.154)

DH,3 := − 18

ψ′(−SH)ψ′′′′(−SH) − 2ψ′′′(−SH)ψ′′(−SH)ψ′(−SH)3

+16

2ψ′(−SH)ψ′′(−SH)ψ′′′(−SH) − 3ψ′′(−SH)3

ψ′(−SH)4

+12

ψ′(−SH)ψ′′′(−SH) − ψ′(−SH)2ψ′′(−SH) − ψ′′(−SH)2

ψ′(−SH)2− ψ′′(−SH) + 2ψ′(−SH)2. (4.155)

We have

mn log d

αH,1(ZH)=mn log d

[n−1/2 − n−1ψ′

H(−SH)ZH + n−3/2(−ψ′′H(−SH)

2+ ψ′

H(−SH)2)(Z2H − 1

ψ′H(−SH)

)

+ n−2(−ψ′′′H (−SH)

6− ψ′

H(−SH)3 + ψ′′H(−SH)ψ′

H(−SH))Z3H

+ n−2(DH,1 + 2ψ′H(−SH)2 − ψ′′

H(−SH))ZH

+ n−5/2((ψ′

H(−SH)4 − 32ψ′

H(−SH)2ψ′′H(−SH) +

14ψ′′

H(−SH)2 +13ψ′

H(−SH)ψ′′′H (−SH) − 1

24ψ′′′′

H (−SH))Z4H

+ (−3ψ′H(−SH)3 +

52ψ′

H(−SH)ψ′′H(−SH) − 1

2ψ′H(−SH)

ψ′′H(−SH)2 − 2ψ′

H(−SH)DH,1 +DH,2

2)Z2

H

+ (ψ′H(−SH) − ψ′′

H(−SH)2ψ′

H(−SH))2 + DH,3

)]+O(mnn−3)

68

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and

αH,2(ZH)(mn log d)2

α3H,1(ZH)

=(mn log d)2[n−3/2 ψ′

H(−SH)2

+ n−2(−3ψ′H(−SH)2

2+

ψ′′H(−SH)

2)ZH

+ n−5/2(ψ′′′

H (−SH)4

− 94ψ′

H(−SH)ψ′′H(−SH) + 3ψ′

H(−SH)3)Z2H

− DH,1

2− 3

2ψ′

H(−SH)2 +34ψ′′

H(−SH)]+O(m2

nn−3)

2αH,2(ZH)2(mn log d)3

α5H,1(ZH)

=(mn log d)3n−5/2 ψ′H(−SH)2

2+ O(m3

nn−3)

αH,3(ZH)(mn log d)3

α4H,1(ZH)

=(mn log d)3n−5/2 ψ′′H(−SH)

6+ O(m3

nn−3).

Therefore,

mn log d −√

n∆ZH

= mn log d[n−1/2ψ′

H(−SH)ZH − n−1(−ψ′′H(−SH)

2+ ψ′

H(−SH)2)(Z2H − 1

ψ′H(−SH)

)

− n−3/2(−ψ′′′H (−SH)

6− ψ′

H(−SH)3 + ψ′′H(−SH)ψ′

H(−SH))Z3H

− n−3/2(DH,1 + 2ψ′H(−SH)2 − ψ′′

H(−SH))ZH

− n−2((ψ′

H(−SH)4 − 32ψ′

H(−SH)2ψ′′H(−SH) +

14ψ′′

H(−SH)2 +13ψ′

H(−SH)ψ′′′H (−SH) − 1

24ψ′′′′

H (−SH))Z4H

+ (−3ψ′H(−SH)3 +

52ψ′

H(−SH)ψ′′H(−SH) − 1

2ψ′H(−SH)

ψ′′H(−SH)2 − 2ψ′

H(−SH)DH,1 +DH,2

2)Z2

H

+ (ψ′H(−SH) − ψ′′

H(−SH)2ψ′

H(−SH))2 + DH,3

)]+ (mn log d)2

[n−1 ψ′

H(−SH)2

+ n−3/2(−3ψ′H(−SH)2

2+

ψ′′H(−SH)

2)ZH

+ n−2(ψ′′′

H (−SH)4

− 94ψ′

H(−SH)ψ′′H(−SH) + 3ψ′

H(−SH)3)Z2H − DH,1

2− 3

2ψ′

H(−SH)2 +34ψ′′

H(−SH)]

+ (mn log d)3n−2(ψ′′

H(−SH)6

− ψ′H(−SH)2

2) + O(m3

nn−5/2) + O(m4nn−4).

Now, we take the expectation of mn log d −√

n∆ZH with use of (4.129), (4.130), (4.131), and (4.132). Then,

the coefficient of the term (mn log d)n−2 equals

(−ψ′′′H (−SH)

6− ψ′

H(−SH)3 + ψ′′H(−SH)ψ′

H(−SH))ψ′′

H(−SH)ψ′

H(−SH)3

− 31

ψ′H(−SH)2

(ψ′H(−SH)4 − 3

2ψ′

H(−SH)2ψ′′H(−SH) +

14ψ′′

H(−SH)2 +13ψ′

H(−SH)ψ′′′H (−SH) − 1

24ψ′′′′

H (−SH))

− 1ψ′

H(−SH)(−3ψ′

H(−SH)3 +52ψ′

H(−SH)ψ′′H(−SH) − 1

2ψ′H(−SH)

ψ′′H(−SH)2 − 2ψ′

H(−SH)DH,1 +DH,2

2)

− (ψ′H(−SH) − ψ′′

H(−SH)2ψ′

H(−SH))2 − DH,3

=0.

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Therefore, we have

E[mn log d −√

n∆ZH ] =(mn log d)2n−1 ψ′H(−SH)

2+ (mn log d)3n−2(

ψ′′H(−SH)

6− ψ′

H(−SH)2

2)

+ (mn log d)2n−2[ ψ′′′

H (−SH)4ψ′

H(−SH)− 9

4ψ′′

H(−SH) + 3ψ′H(−SH)2 − DH,1

2− 3

2ψ′

H(−SH)2 +34ψ′′

H(−SH)]

+ O(m3nn−5/2) + O(m4

nn−4)

=(mn log d)2n−1 ψ′H(−SH)

2+ (mn log d)3n−2(

ψ′′H(−SH)

6− ψ′

H(−SH)2

2)

+ (mn log d)2n−2(ψ′′

H(−SH)2ψ′

H(−SH)− ψ′

H(−SH))2

+ O(m3nn−5/2) + O(m4

nn−4). (4.156)

Hence, we obtain (4.122).

Similar to (4.142), due to the definition (4.137), we have

DBL(mn) =E[−(mn log d) +√

n∆LZL]. (4.157)

Following the same way as (4.122), we obtain (4.123) by solving (4.141).

4.2.6.2 Perturbation for higher order equation

Lemma 14. Consider the equation

ϵ =l∑

i=1

aixi. (4.158)

When ϵ is sufficiently small, the solution x is approximated as

x =l∑

i=1

ϵixi + O(ϵl+1). (4.159)

where x1 is given as 1a1

and xl with l ≥ 2 is inductively given as − 1a1

∑i1,i2,...,il−1:

Pl−1k=1 kik=l a

Pl−1k=1 ik

(Pl−1

k=1 ik)!Ql−1

k=1 ik!

∏l−1k=1 xik

k .

Specially, x2 and x3 are given as

x2 = − 1a1

x21 = − 1

a31

(4.160)

x3 = − 1a1

(x31 + 2x1x2) = − 1

a41

+2a51

. (4.161)

This lemma can be shown as follows. First, we substitute (4.159) into (4.158). Then, compare the coefficients

with the order ϵi. Hence, we obtain xl = − 1a1

∑i1,i2,...,il−1:

Pl−1k=1 kik=l a

Pl−1k=1 ik

(Pl−1

k=1 ik)!Ql−1

k=1 ik!

∏l−1k=1 xik

k .

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Chapter 5

Summary and future works

In the present thesis, we solved two theoretical problems about the quantum heat engines by using quantum

information theory.

First, we have reconsidered the formulation of the work extraction from the viewpoint of quantum mea-

surement theory, and clarified a serious conflict between the internal unitary scenario and the fully quantum

scenario. We give a trade-off inequality which means that we have to destroy the coherence of the thermo-

dynamic system in order to know the amount of the extracted energy; namely, a work extraction must be a

measurement. Based on the fact, we have formularized the work extractions as a measurement process, and

putted the previous formulations in order in a hierarchical structure. As a by-product, our formulation gives

us a powerful tool to analyze the thermodynamic features of quantum heat engines; when the initial state is

classical, we can analyze the classical model as a substitution for quantum heat engines.

Second, we have assessed how accurately thermodynamics gives an approximation to the optimal efficiency of

heat engines composed of a finite-particle working body and finite-particle heat baths, by using large deviation

theory. We microscopically derive a thermodynamical upper bound for the efficiency of finite-size heat engines

with two heat baths that are composed of n identical particles. It is not the upper limit, but we can obtain an

asymptotic approximation of the true upper limit by expanding our upper bound asymptotically in terms of qn :=

QH,n/n, where QH,n is the extracted heat from the hot bath. Thus, the difference between the thermodynamical

upper bound and the true upper limit is at most in the order of O(q2n) in case of the particles in each heat baths

does not interact with each others. Our results also include another proof of the achievability of the Carnot

efficiency in the macroscopic limit, and the first example of quantitative understanding of thermodynamic laws

for the quantum systems which consist of many, but finite praticles.

Finally, as the discussion, we introduce two future works.

Refinement of the principle of maximum work

It is natural to expect that there exists the refined version not only for Carnot’s Theorem, but also other

expressions of the second law.

Reconstruction of the information thermodynamics

Because every work extraction is a measurement process in our formulation, the information thermody-

namics should be reconstructed in our formulation. Note that the information which is obtained by the

measurement process can be used in two ways; one is used to know Therefore, there might be a trade-off

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relation between how much we can extract work and how precice we can know the amount of the extracted

work.

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Appendix A

The comparison (2.16) with (2.65) in

terms of achievability

In the present appendix, we prove that the converse of the corollary 1 is not true. To be concrete, we prove the

following two theorems;

Theorem 8. When the following conditions are satisfied, we can always achieve the equality of Eq. (2.65) with

proper choices of {P(k)} and {U(k)} for any USM :

Condition 1: The system S is a two-level system.

Condition 2: We omit Step 1 in the isothermal operation with feedback control which is defined in the

subsection 2.2.1. Namely, we use ρi as ρ1.

Condition 3: During the measurement {Ej} in Step 2, the system S and the heat bath B does not interact

with each others.

Condition 3 implies that the system and baths do not interact during the measurement; if the system and

baths interact during the measurement, the information obtained by the memory contains the information about

the system as well as about the baths.

Theorem 9. Under Conditions 1–3, there is a measurement {E(j)} for which we cannot achieve the equality of

Eq. (2.16) with any U(j).

We prove Theorem 8 by using the following lemma;

Lemma 15. For an arbitrary three-qubit pure state |ψMSR1⟩, there exists a projective measurement {P(k)}k=0,1

such that the results P(k)√pk

|ψMSR1⟩ are LU-equivalent for k = 0, 1 and

ES-R1(P(k)√

pk|ψMSR1⟩) = ES-R1

F (ρSR1) (A.1)

is valid, where ρSR1 := trM [|ψMSR1⟩⟨ψMSR1 |].

Proof of Theorem 8: In order to perform the proof, we firstly introduce the reference systems R1 and R2,

and the pure states |ψSR1⟩ and |ψBR1⟩ of SR1 and SR2 such that

trR1 [|ψSR1⟩⟨ψSR1 |] =exp(−βHS

1 )ZS(HS

i , β), trR2 [|ψBR2⟩⟨ψBR2 |] =

exp(−βHB1 )

ZB(HB , β)(A.2)

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Because of Condition 2, the premeasurement state of MSBR1R2 is |0M ⟩ ⊗ |ψSR1⟩ ⊗ |ψBR1⟩. Because of

Condition 3, after the unitary interaction USM , the state of MSBR1R2 becomes USM (|0M ⟩⊗|ψSR1⟩)⊗|ψBR1⟩.Thus, the following equality holds;

−∆ESB−RF = −∆ES−R

F . (A.3)

Let us take the projective measurement {P(k)} for |ψ′MSR1

⟩ := USM (|0M ⟩ ⊗ |ψSR1⟩), and perform it on the

memory M . Because the system S is a qubit, and because P(k)√pk

∣∣ψ′MSR1

⟩are LU-equivalent for k = 0, 1, there

exist the unitary transformations V(k) on S such that

1p0

trR1 [V(0)P(0)|ψ′MSR1

⟩⟨ψ′MSR1

|P(0)V†(0)] =

1p1

trR1 [V(1)P(1)|ψ′MSR1

⟩⟨ψ′MSR1

|P(1)V†(1)] = ρG,β′(HS

i ), (A.4)

for an inverse temperature β′ which is not always equal to β. Because S is a qubit, we can turn ρG,β′(HSi ) into

ρG,β′(HSf ) by adiabatic transformation V on S, with a proper Hamiltonian HS

f .

Let us show that the projective measurement {P(k)} and the feedback {V V(k)} satisfy the equality of (2.65).

Because of (A.1), the {P(k)} is the projective measurement which achieves the equality of (2.58). Moreover,

because the state of S becomes the Gibbs state whose inverse temperature β after the feedback V V(k), the sum∑j pjD(ρj

f ∥ρG,β(HSf )) is equal to zero. Thus, (2.24) yields

Wfb = − 1β

∆ESB−RF − ∆FS(β). (A.5)

Thus, {P(k)} and {V(k)} are the measurement and feedback that we want.¤Proof of Theorem 9: It is sufficient to prove the existence of a counterexample of the measurement {E(j)}.

Because of (2.24), the equality of Eq. (2.16) is valid only if there exists a set of unitary transformations {U(k)}that satisfy

∑j

pjD(ρjf ∥ρG,β(HS

f )) = 0. (A.6)

Because D(ρ||ρ′) = 0 if and only if ρ = ρ′, the equality (A.6) means that every ρj2 are LU-equivalent for j = 0, 1,

in other words, the measurement {E(j)} is a deterministic measurement. Because of this logic, if Theorem 9 were

not valid, any measurement {E(j)} would be deterministic. This is clearly false, and thus Theorem 9 holds.¤Proof of Lemma 15: Because ρSR1 is a two-qubit mixed state, we can express ES-R1

F (ρSR1) in the form

of the concurrence [55]:

ES-R1F (ρSR1) = h

1 +√

1 − C2SR1

(ρSR1)

2

, (A.7)

where CSR1(ρSR1) is the concurrence of ρSR1 and h(x) ≡ −xlogx − (1 − x)log(1 − x). Thus, we only have to

find a projective measurement {P(k)}k=0,1 such that P(k) |ψMSR1⟩ for k = 0, 1 are LU-equivalent to each other

and CSR1(P(k) |ψMSR1⟩) = CSR1(ρSR1).

Before giving the projective measurement {P(k)}, we first present preparations. First we express |ψMSR1⟩in the form of the generalized Schmidt decomposition [64]:

|ψMSR1⟩ = λ0 |000⟩ + λ1eiϕ |100⟩ + λ2 |101⟩

+λ3 |110⟩ + λ4 |111⟩ (0 ≤ ϕ ≤ π) (A.8)

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and introduce the following eight parameters [62];

KMS ≡ C2MS + τMSR1 , (A.9)

KMR1 ≡ C2MR1

+ τMSR1 , (A.10)

KSR1 ≡ C2SR1

+ τMSR1 , (A.11)

J5 ≡ 4λ20(|λ1λ4e

iϕ − λ2λ3|2 + λ22λ

23 − λ2

1λ24), (A.12)

K5 ≡ J5 + τMSR1 , (A.13)

∆J ≡ K25 − KMSKMR1KSR1 , (A.14)

e−iϕ5 ≡ λ2λ3 − λ1λ4eiϕ

|λ2λ3 − λ1λ4eiϕ|, (A.15)

Qe ≡ sgn[sinϕ

(λ2

0 −τMSR1 + J5

2(C2SR1

+ τMSR1)

)], (A.16)

where τMSR1 is the tangle of |ψMSR1⟩ and sgn[x] is the sign function,

sgn[x] =

x/|x| (x = 0)

0 (x = 0)

. (A.17)

When Qe = 0, there are two possible decompositions which satisfy Eq. (B.1). We then choose the decomposition

with a greater coefficient λ0.

Now we have completed the preparation. In the basis of Eq. (B.1), the projective measurement {P(k)}k=0,1

is given as follows:

P(0) =

√√√√√ a ke−iθ

keiθ b

, P(1) =

√√√√√ 1 − a −ke−iθ

−keiθ 1 − b

, (A.18)

where the measurement parameters a, b, k and θ are defined as follows:

a =12−

K5τMSR1±√

∆JC2SR1

2KSR1

√K2

5 − KMSKMR1C2SR1

, (A.19)

b = 1 − a, (A.20)

k =√

a(1 − a), (A.21)

θ = −ϕ5, (A.22)

and when Qe = 0 the mark ± means −Qe and when Qe = 0 the mark ± means −. By using Eqs. (B.84)–(B.87)

and Lemma 16 in Appendix B and after straightforward algebra, we can confirm that the measurement {P(k)}is the measurement that we sought.

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Appendix B

Deterministic LOCC transformation of

three-qubit pure states

In the present appendix, we give an explicit necessary and sufficient condition to determine whether a deter-

ministic LOCC transformation from an arbitrary three-qubit pure state |ψ⟩ to another arbitrary state |ψ′⟩ is

executable or not. The contents in the present appendix are in the sections 2, 3 and 4 of the author’s result

Ref. [62]

B.1 Theorems and their physical meanings

In this section, we list up Theorems in this article and describe their physical meaning.

We consider only three-qubit pure states throughout the present paper. Before listing up Theorems, we

introduce a useful expression of three-qubit pure states. An arbitrary pure state |ψ⟩ of the three qubits A, B

and C is expressed in the form of the generalized Schmidt decomposition

|ψ⟩ = λ0 |000⟩ + λ1eiϕ |100⟩ + λ2 |101⟩ + λ3 |110⟩ + λ4 |111⟩ (B.1)

with a proper basis set [64]. (There are two kinds of decompositions which are called generalization of the

Schmidt decomposition. One was given in Ref. [64] and the other was given in Ref. [65]. We use the former

in the present paper.) The coefficients {λi|i = 0, ..., 4} in (B.1) are nonnegative real numbers and satisfy that∑4i=0 λ2

i = 1. Note that the phase ϕ can take any real values if one of the coefficients {λi|i = 0, ..., 4} is zero,

in which case we define the phase ϕ to be zero in order to remove the ambiguity.

Two different decompositions of the form (B.1) are possible for the same state |ψ⟩, one with 0 ≤ ϕ ≤ π and the

other with π ≤ ϕ ≤ 2π. These two decompositions are LU-equivalent; in other words, they can be transformed

into each other by local unitary (LU) transformations. Hereafter, we refer to the decomposition (B.1) with

0 ≤ ϕ ≤ π as the positive decomposition and the one (B.1) with π < ϕ < 2π as the negative decomposition.

We also refer to the coefficients of the positive and negative decompositions as the positive-decomposition

coefficients and the negative-decomposition coefficients, respectively. Therefore, a set of coefficients gives a

unique set of states that are LU-equivalent to each other, whereas such a set of states may give two possible

sets of coefficients: for ϕ = 0, a set of positive-decomposition coefficients and a set of negative-decomposition

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Particle A

Paticle B Particle CCBC

2

(a)

Particle A

Paticle B Particle C

CAB

2CAC

2

(b)

Figure B.1: The concept of (a) a biseparable state. There is no such state as (b).

coefficients are possible, while for ϕ = 0, two sets of positive-decomposition coefficients are possible. When

sinϕ = 0 holds, a set of LU-equivalent states and a set of positive-decomposition coefficients have a one-to-one

correspondence.

We can express the entanglement parameters in the coefficients of the generalized Schmidt decomposition:

CAB = 2λ0λ3, CAC = 2λ0λ2, CBC = 2|λ1λ4eiϕ − λ2λ3|, (B.2)

τABC = 4λ20λ

24, (B.3)

J5 = 4λ20(|λ1λ4e

iϕ − λ2λ3|2 + λ22λ

23 − λ2

1λ24), (B.4)

where τ is the tangle [56], CAB , CAC and CAC are the concurrences [71], and J5 is four times of J5 in Ref. [64].

Finally, we define the names of types of states. We refer to a state whose τABC is nonzero or whose CAB ,

CAC and CBC are all nonzero as a truly tripartite state. We refer to a state which has only a single kind of

the bipartite entanglement as a biseparable state (Fig. B.1(a)). Note that there is no state which has only two

kinds of the bipartite entanglement (Fig. B.1(b)). If there were such a state as in Fig. B.1(b), the coefficients

{λi, ϕ|i = 0, ..., 4} of the state would satisfy

λ0λ2 = 0, λ0λ3 = 0, λ0λ4 = 0, |λ1λ4eiϕ − λ2λ3| = 0, (B.5)

but (B.5) is impossible.

The preparation has been now completed. Let us give Theorems and see their meaning.

Theorem 10. (Condition for the LU-equivalence)

Arbitrary three-qubit pure states are LU-equivalent if and only if their entanglement parameters (CAB , CAC , CBC , τABC , J5, Qe)

are equal to each other. Here Qe is a new parameter which is given by

Qe = sgn[sinϕ

(λ2

0 −τABC + J5

2(C2BC + τABC)

)], (B.6)

where sgn[x] is the sign function,

sgn[x] =

x/|x| (x = 0)

0 (x = 0)

, (B.7)

and the parameters ϕ and λ0 are the coefficients of the generalized Schmidt decomposition.

Physical meaning of Theorem 10: Theorem 10 gives a necessary and sufficient condition for the LU-

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equivalence of three-qubit pure states. The necessary and sufficient conditions can be given in other ways.

However, the parameters used in Theorem 10 have very clear physical meaning of the magnitude, phase and

charge of the entanglement, in the space of the LU-equivalence class of three-qubit pure states.

The concurrences CAB , CAC and CBC express the amount of the entanglement between the qubits A and

B, A and C and B and C, respectively. The tangle τABC expresses the amount of the entanglement among

three qubits.

What about J5? The parameter J5 and the concurrences let us derive a phase of the entanglement as follows:

cos ϕ5 =J5

CABCACCBC, 0 ≤ ϕ5 ≤ π. (B.8)

Let us refer to the phase ϕ5 as the entanglement phase (EP). The entanglement phase ϕ5 is invariant with respect

to local unitary operations, because all of the parameters J5 and CAB CAC CBC are. When CABCACCBC = 0,

the phase becomes indefinite. Hereafter, we refer to a state whose entanglement phase ϕ5 is definite as an

EP-definite state and to a state whose entanglement phase ϕ5 is indefinite as an EP-indefinite state. An EP-

indefinite state with τABC = 0 and an EP-definite state are truly tripartite states. A truly tripartite state is an

EP-indefinite state with τABC = 0 or an EP-definite state. A biseparable state is EP indefinite with τABC = 0.

An EP-indefinite state with τABC = 0 is a biseparable state.

Finally, we interpret the new parameter Qe. As we will prove in section B.2, the parameter Qe is equal

for the possible sets of coefficients of a state. Therefore, the parameter Qe is invariant with respect to local

unitary transformations. The parameter Qe is a tripartite parameter, because Qe is invariant with respect

to the permutation of the qubits A, B and C. This fact is shown in Appendix A. The complex-conjugate

transformation of a state does not change the parameters (CAB , CAC , CBC , τABC , J5) nor λ0, but reverses the

sign of sin ϕ. Thus, the complex-conjugate transformation reverses the sign of Qe. As we have seen, the

parameter Qe has characters that the electric charge has; hence, we refer to Qe as the entanglement charge.

The next Theorem 11 gives a necessary and sufficient condition for the possibility of a deterministic LOCC.

In order to express Theorem 11 in simpler forms, we define three nonnegative real-valued parameters KAB ,

KAC and KBC as follows:

KAB = C2AB + τABC , KAC = C2

AC + τABC , KBC = C2BC + τABC . (B.9)

Then, the five parameters KAB , KAC , KBC , τABC and J5 are independent of each other and are invari-

ant with respect to local unitary operations. We can substitute these five parameters for the entanglement

parameters (CAB , CAC , CBC , τABC , J5). Let us refer to the old parameters (CAB , CAC , CBC , τABC , J5) as

the C-parameters and to the new parameters (KAB , KAC ,KBC , τABC , J5) as the K-parameters. Note that

(CAB , CAC , CBC , τABC , J5) and (KAB ,KAC ,KBC , τABC , J5) have a one-to-one correspondence.

We also define three parameters in order to simplify expressions which often appear in the present paper:

Jap ≡ C2ABC2

ACC2BC , Kap ≡ KABKACKBC , K5 ≡ τABC + J5, (B.10)

∆J ≡ K25 − Kap ≥ 0, (B.11)

where the subscript ap is abbreviation of all pairs, and where ∆J is sixteen times of ∆J in Ref. [64]. Note that

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these parameters Jap, Kap, K5 and ∆J are not included in the K-parameters; we introduce them only for

simplicity. By definition, Jap, Kap, K5 and ∆J are invariant with respect to local unitary transformations as

well as permutations of A, B and C.

Theorem 11. (deterministic LOCC)

A deterministic LOCC transformation from an arbitrary state |ψ⟩ to another arbitrary state |ψ′⟩ is executable

if and only if the K-parameters of |ψ⟩ and |ψ′⟩ satisfy the following conditions:

Condition 1: There are real numbers 0 ≤ ζA ≤ 1, 0 ≤ ζB ≤ 1, 0 ≤ ζC ≤ 1 and ζlower ≤ ζ ≤ 1 which satisfy

the following equation:

K ′AB

K ′AC

K ′BC

τ ′ABC

J ′5

= ζ

ζAζB

ζAζC

ζBζC

ζAζBζC

ζAζBζC

KAB

KAC

KBC

τABC

J5

, (B.12)

where

ζlower =Jap

(KAB − ζCτABC)(KAC − ζBτABC)(KBC − ζAτABC). (B.13)

Condition 2: If the state |ψ′⟩ is EP definite, we check whether

(∆J = 0) ∧ (Jap − J25 = 0) (B.14)

holds or not. When (B.14) does not hold, the condition is

Qe = Q′e and ζ = ζ, (B.15)

where

ζ ≡Kap(Jap − J2

5 ) + ∆JJapKap(Jap − J2

5 ) + ∆J(KAB − ζCτABC)(KAC − ζBτABC)(KBC − ζCτABC). (B.16)

When (B.14) holds, the condition is

|Q′e| = sgn[(1 − ζ)(ζ − ζlower)], (B.17)

or in other expressions,

Q′e

= 0 (ζ = 1 or ζ = ζlower),

= 0 (otherwise).(B.18)

Physical meaning of Theorem 11: Theorem 11 gives a necessary and sufficient condition for the possi-

bility of a deterministic LOCC (d-LOCC) transformation. Note that the conditions are given as the condition

for a diagonal matrix which relates two vectors of the K-parameters. This shows that there exists a vector

structure in three-qubit pure states.

The difficulty of seeking necessary and sufficient conditions for the possibility of multipartite d-LOCC trans-

formation lies in the fact that we cannot apply the majorization theory, which played an important part in

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clarifying bipartite-pure d-LOCC transformation, to multipartite pure states. The majorization theory was

applied to a vector structure which exists in the coefficients of the Schmidt decomposition. Unfortunately, there

is not a vector structure in the coefficients of the generalized Schmidt decomposition, but a tensor structure.

Thus, the majorization theory is not applicable to three-qubit pure states directly; this was the reason of the

difficulty of clarification of three-qubit d-LOCC transformation.

However, Theorem 11 implies that there is a vector structure in three-qubit states in view of the entanglement

measures. Note that there is a possibility that other multipartite systems have similar structures; it is plausible

that the nonlocal features of N -qubit pure states can be expressed completely in the magnitudes, phases and

charges of the entanglement. Then, the approach of the present paper may be applicable to such systems.

There are two important interpretations of Theorem 11. One is the rule of the flow of the entanglement

and the other is the preservation of the charge. Let us see the rule of the flow of the entanglement. Consider a

d-LOCC transformation whose measurement is performed only on the qubit A. In such a case, the condition 1

reduces to the following condition 1′: there are real numbers 0 ≤ ζA ≤ 1 and ζlower ≤ ζ ≤ 1 which satisfy the

following equation:

K ′AB

K ′AC

K ′BC

τ ′ABC

J ′5

= ζ

ζA

ζA

1

ζA

ζA

KAB

KAC

KBC

τABC

J5

, (B.19)

where

ζlower =C2

BC

(KBC − ζAτABC). (B.20)

Substituting the C-parameters (CAB , CAC , CBC , τABC , J5) for the K-parameters in (B.19), we obtain the fol-

lowing condition 1′′: 0 ≤ αA ≤ 1, 0 ≤ βA ≤ 1 which satisfy the following equation:

C ′2AB

C ′2AC

C ′2BC

τ ′ABC

J ′5

=

α2A

α2A

1 βA(1 − α2A)

α2A

α2A

C2AB

C2AC

C2BC

τABC

J5

. (B.21)

We can interpret the above as the rule how a deterministic measurement, which is a measurement whose results

can be transformed into a unique state by local unitary operations without exception, changes the entanglement.

We can express this change as in Fig. B.2. After performing a deterministic measurement on the qubit A, the

four entanglement parameters, C2AB , C2

AC , τABC and J5, the last of which does not appear in Fig. B.2, are

multiplied by α2A. Note that these four entanglement parameters are related to the qubit A, which is the

measured qubit. The quantity βA(1 − α2A)τABC , which is a part of the entanglement lost from τABC , is added

to C2BC , which is the only entanglement parameter that is not related to the measured qubit A. The quantity

(1−βA)(1−α2A)τABC , which is the rest of the entanglement lost from τABC disappear. We call this phenomenon

the entanglement transfer.

Finally, let us see the behavior of Qe when we perform a d-LOCC transformation. Hereafter, we refer to a

state which satisfies (B.14) as ζ-indefinite and refer to a state which does not satisfy (B.14) as ζ-definite. The

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qubit A

qubit B qubit C+βA(1-αA)

2

(1-βA)(1-αA)is lost

×αA2 ×αA

2

×αA

2CAB

2

CBC2

CAC

2

ABC

ABC

ABC

Figure B.2: Entanglement transfer

ζ ~-indefinite

ζ ~-definite

Qe=0

Qe=1

Qe=0

Qe= -1

Figure B.3: The entanglement charge Qe for ζ-definite states and ζ-definite states. The arrows indicate theexecutable deterministic LOCC transformations among truly multipartite states; transformations not in thisfigure are not executable as deterministic LOCC transformations. For example, we cannot transform a ζ-definitestate whose Qe is 1 into another ζ-definite state whose Qe is 0.

following statements hold:

Statement ζ-1: Any biseparable state is also a ζ-indefinite state.

Statement ζ-2: Any ζ-indefinite state satisfies Qe = 0.

Statement ζ-3: A d-LOCC transformation from an EP-indefinite state to an EP-definite state is executable

if and only if the initial state is ζ-indefinite.

Statement ζ-4: Among truly multipartite states, a d-LOCC transformation from a ζ-indefinite state to a

ζ-definite state is executable, but the contrary is not executable.

Statement ζ-5: When the initial state is ζ-definite, the d-LOCC transformation conserves the entanglement

charge Qe.

Because of the above five statements, the ζ-definite state can be considered as a “charge-definite state.” When

we transform a ζ-indefinite state into a ζ-definite state, we can choose the value of the entanglement charge

Qe; once the value is determined, we cannot change it anymore with a deterministic LOCC transformation

(Fig. B.3).

The third theorem gives the minimum number of times of measurements to reproduce an arbitrary deter-

ministic LOCC transformation between three-qubit pure states.

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Table B.1: The minimum number of times of measurements to reproduce an arbitrary deterministic LOCCtransformation.

Initial state Final state TimesTruly tripartite state Truly tripartite state 3Truly tripartite state Biseparable state or full-separable state 2Biseparable state Biseparable state or full-separable state 1Full-separable state Full-separable state 0

Theorem 12. the minimum number of necessary times of measurements The minimum number of necessary

times of measurements to reproduce an arbitrary deterministic LOCC transformation from an arbitrary three-

qubit state |ψ⟩ to another arbitrary state |ψ′⟩ is given as listed in Table 1. The order of measurements are

commutable; we can choose which qubit is measured first, second and third.

B.2 Proof of Theorem 10

In this section, we prove Theorem 10. We perform the proof in the following two steps. First, we see that the

C-paramters (CAB , CAC , CBC , τABC , J5) does not specify an LU-equivalence class uniquely. Second, we show

that the entanglement charge Qe eliminate the non-uniqueness.

When we specify the set (CAB , CAC , CBC , τABC , J5), there are still two possible positive decompositions [66]:

(λ±0 )2 =

J5 + τABC ±√

∆J

2(C2BC + τABC)

=K5 ±

√∆J

2KBC, (B.22)

(λ±2 )2 =

C2AC

4(λ±0 )2

, (λ±3 )2 =

C2AB

4(λ±0 )2

, (λ±4 )2 =

τABC

4(λ±0 )2

, (B.23)

(λ±1 )2 = 1 − (λ±

0 )2 − C2AB + C2

AC + τABC

4(λ±0 )2

, (B.24)

cos ϕ± =(λ±

1 )2(λ±4 )2 + (λ±

2 )2(λ±3 )2 − C2

BC/42λ±

1 λ±2 λ±

3 λ±4

, (B.25)

where

0 ≤ ϕ± ≤ π. (B.26)

Thus, there are four possible sets of coefficients for one set of (CAB , CAC , CBC , τABC , J5): the positive-

decomposition coefficients {λ+i , ϕ+|i = 0, ..., 4} and {λ−

i , ϕ−|i = 0, ..., 4} as well as other two sets of coeffi-

cients {λ+i , ϕ+|i = 0, ..., 4} and {λ−

i , ϕ−|i = 0, ..., 4}, where ϕ± = 2π − ϕ± with π ≤ ϕ± ≤ 2π. A state with

{λ+i , ϕ+|i = 0, ..., 4} is LU-equivalent to a state with {λ−

i , ϕ−|i = 0, ..., 4}, while a state with {λ−i , ϕ−|i = 0, ..., 4}

is LU-equivalent to a state with {λ+i , ϕ+|i = 0, ..., 4} [66]. Therefore we can focus on two possible positive-

decomposition coefficients {λ+i , ϕ+|i = 0, ..., 4} and {λ−

i , ϕ−|i = 0, ..., 4} for a set of (CAB , CAC , CBC , τABC , J5).

Next, we prove that the entanglement charge Qe eliminates the non-uniqueness and that two states are

LU-equivalent if and only if the six parameters (CAB , CAC , CBC , τABC , J5, Qe) of the two states are equal to

each other. If Qe = 0, we can determine one positive-decomposition coefficients and one negative-decomposition

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LU-equivalentLU-equivalent

Same if

Same if

Same if

Figure B.4: The relation among the four sets of coefficients for Qe = 0. The relations indicated by solid linesare always valid, while those indicated by dotted lines are valid if and only if the noted conditions are satisfied.

coefficients uniquely from the parameters (CAB , CAC , CBC , τABC , J5, Qe) as follows:

λ20 =

J5 + τABC+Qe√

∆J

2(C2BC + τABC)

=K5+Qe

√∆J

2KBC, (B.27)

λ22 =

C2AC

4λ20

, λ23 =

C2AB

4λ20

, λ24 =

τABC

4λ20

, (B.28)

λ21 = 1 − λ2

0 −C2

AB + C2AC + τABC

4λ20

, (B.29)

cos ϕ =λ2

1λ24 + λ2

2λ23 − C2

BC/42λ1λ2λ3λ4

, (B.30)

where + is + or − when {λi, ϕ|i = 0, ..., 4} are positive-decomposition coefficients or negative-decomposition

coefficients, respectively. Thus, if Qe = 0, the set of (CAB , CAC , CBC , τABC , J5) together with the entanglement

charge Qe gives a unique set of LU-equivalent states. Note that when Qe = 0, the parameter Qe is equal for

the possible sets of coefficients of a state, because of (B.27)–(B.30).

If Qe = 0, at least one of sin ϕ and ∆J is zero because of (B.6) and (B.22). If sin ϕ is zero, {λ±i , ϕ±|i = 0, ..., 4}

and {λ±i , ϕ±|i = 0, ..., 4} are equal. If ∆J is zero, {λ+

i , ϕ+|i = 0, ..., 4} and {λ−i , ϕ−|i = 0, ..., 4} are equal as

{λ+i , ϕ+|i = 0, ..., 4} and {λ−

i , ϕ−|i = 0, ..., 4} are, respectively, because of (B.22). Thus, if Qe is zero, the four

sets of coefficients {λ+i , ϕ+|i = 0, ..., 4}, {λ−

i , ϕ−|i = 0, ..., 4}, {λ+i , ϕ−|i = 0, ..., 4} and {λ−

i , ϕ−|i = 0, ..., 4}are LU-equivalent (Fig. B.4). Thus, if Qe = 0, the set of (CAB , CAC , CBC , τABC , J5) gives a unique set of

LU-equivalent states. Note that the above guarantees that when Qe = 0, the parameter Qe is equal for the

possible sets of coefficients of a state. Incidentally, a state is LU-equivalent to its complex-conjugate if and

only if its entanglement charge Qe is zero. The complex conjugate transformation of the state only changes

the sign of ϕ. Thus, a state is LU-equivalent to its complex conjugate if and only if {λ±i , ϕ±|i = 0, ..., 4} are

LU-equivalent to {λ±i , ϕ±|i = 0, ..., 4}; this LU-equivalence is illustrated in Fig. B.4.

For the reasons stated above, the set of (CAB, CAC , CBC , τABC , J5) together with the entanglement charge

Qe gives a unique set of LU-equivalent states. In other words, two states are LU-equivalent if and only if the

C-parameters (CAB , CAC , CBC , τABC , J5, Qe) of the two states are equal to each other. This is the statement

of Theorem 10, and thus the proof is completed. ¤

Note that a state is LU-equivalent to its complex conjugate if and only if Qe = 0. Thus, the condition

Qe = 0 is equivalent to E6 = 0 in Ref. [57].

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B.3 The Proof of Theorem 11

In this section, we prove Theorem 11. All the deterministic LOCC transformations are categorized into any of

the following cases determined by the initial and final states:

Case A: Both of the initial and final states are EP definite and the initial state is GHZ-type.

Case B: The initial state is EP definite and the final state is EP indefinite.

Case C: The initial state is EP indefinite and GHZ-type.

Case D: The tangle of initial state is zero.

Note that these four Cases exhaust all cases of the initial and final states; (Proof : The case where both the

initial and final states are EP-definite is exhausted by Cases A, C and D. The case where the initial state is

EP-definite and the final state is EP-indefinite is Case B. The case where the initial state is EP-indefinite is

exhausted by Cases C and D.¤)

We carry out the proof of each Case in sections B.3.1–B.3.4, respectively.

B.3.1 Case A

First, we prove Theorem 11 in Case A, where both of the initial and final states are EP definite and the initial

state is GHZ-type. We will argue that we can assume the final state to be GHZ-type too. The final state after

an LOCC transformation is EP definite, and hence the final state is a truly multipartite state. We cannot reach

a W-type state from a GHZ-type initial state with an LOCC transformation [67]. Thus the final state must be

GHZ-type. We can also show that if the initial and final states satisfy the two conditions of Theorem 11, the

final state must be GHZ-type. (Proof : If the final state would not be GHZ-type, then τ ′ABC would be zero, and

thus at least one of ζ, ζA, ζB and ζC would be zero. Then, at least one of K ′AB , K ′

AC and K ′BC would be zero.

Because of K ′ap ≥ J ′ap, the final state would not be W-type. An EP-definite state is GHZ-type or W-type,

and thus this is a contradiction. ¤) Thus, in the present case, we only have to consider the case in which both

initial and final states are GHZ-type. In this case, a necessary and sufficient condition of the possibility of a

d-LOCC transformation is already given [68]. Thus, in the present case, we only have to prove the equivalence

between the conditions of Theorem 11 and the necessary and sufficient condition.

An arbitrary GHZ-type state can be expressed as follows [68]:

|ψ⟩ =1√N

(∣∣0A0B 0C

⟩+ z

∣∣1A1B 1C

⟩), (B.31)

where {∣∣0i

⟩|i = A,B,C} and {

∣∣1i

⟩|i = A,B,C} are normalized states of the qubits A, B and C, with their

relative phases adjusted such that all of ci ≡⟨0i|1i

⟩are real and non-negative, while z is an arbitrary complex

number and N is the normalization constant. There are two possible expressions of the form (B.31) for an

arbitrary state. These two expressions have the same values of {ci} but different values of z. The relation

between the two values of z is as follows:

If there is no zeros in the set {ci} : z1 =1z2

, (B.32)

If there is a zero in the set {ci} : |z1| =1|z2|

, (B.33)

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where z1 and z2 are the values of z in the two possible expressions of the form (B.31).

When the set {ci} of the states |ψ⟩ and the set {c′i} of |ψ′⟩ have no zeros, a d-LOCC transformation from

the state |ψ⟩ to the state |ψ′⟩ is executable if and only if the following expressions are satisfied [68]:

c′i ≥ ci (k = A,B,C), (B.34)s′

s=

cAcBcC

c′Ac′Bc′C, (B.35)

n′

n=

cAcBcC

c′Ac′Bc′C, (B.36)

where

n ≡ 2Re[z]|z|2 + 1

, s ≡ 2Im[z]|z|2 − 1

(B.37)

with the parameter z of the state |ψ⟩, and s′ and n′ are defined for the state |ψ′⟩ with the parameter z′. The

parameter z can take the two different values, but n and s have the same values for each value of z, except for

z = ±1; when (|z| = 1)∧ (z = ±1), we consider the parameter s to take one value ∞. In the case where z = ±1,

the parameter s becomes indefinite; it becomes 0/0. When the parameter s becomes indefinite, we only leave

out (B.35). The parameter s is indefinite if and only if z = ±1. As we will show later, the equation z = ±1

is equivalent to (B.14) in Theorem 11. There are two other cases where we have to treat (B.35) and (B.36)

exceptionally; the case where at least one of s and s′ becomes 0 or ∞, and the case where at least one of n and

n′ becomes 0. In the former case, we consider that (B.35) holds if and only if s and s′ has the same value; for

example, if s takes ∞, the equation (B.35) holds if and only if s′ = ∞. In the same manner, in the latter case,

we consider that (B.36) holds if and only if n and n′ has the same value.

Let us prove that (B.34)–(B.36) are equivalent to the conditions of Theorem 11. We can express the

paramters z and {ci} in terms of the C-paramters:

z = −√

KABKAC

2λ20

√KBC

e−iϕ5 , (B.38)

cA =CBC√KBC

, cB =CAC√KAC

, cC =CAB√KAB

, (B.39)

where

e−iϕ5 =λ2λ3 − λ1λ4e

|λ2λ3 − λ1λ4eiϕ|= cos ϕ5 − isgn[sin ϕ] sin ϕ5. (B.40)

Because there are two possible sets of {λi, ϕ|i = 0, ..., 4} in (B.38), the parameter z takes two values, which are

z1 and z2 in (B.32) and (B.33). The derivation of the above expressions is given in Appendix B. It is easily seen

from (B.39) that the set {ci} of a state has no zeros if and only if the state is EP-definite. Now that we have

reduced Case A into the case in which the initial and final states are EP-definite and GHZ-type, we only have

to prove that (B.34)–(B.36) are equivalent to the conditions of Theorem 11.

Using (B.38) and (B.39), we prove that (B.34) and (B.36) are equivalent to the condition 1 of Theorem 11

except for ζlower ≤ ζ ≤ 1. Substituting (B.39) into (B.34), we transform (B.34) into

τ ′ABC

τABC≤ K ′

AB

KAB,

τ ′ABC

τABC≤ K ′

AC

KAC,

τ ′ABC

τABC≤ K ′

BC

KBC. (B.41)

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Because of (B.40),

Re[z] = −√

KABKAC

2λ20

√KBC

cosϕ5. (B.42)

Because the possible two sets of {λi, ϕ|i = 0, ..., 1} are {λ+i , ϕ+|i = 0, ..., 1} and {λ−

i , ϕ−|i = 0, ..., 1} or

{λ−i , ϕ−|i = 0, ..., 1} and {λ+

i , ϕ+|i = 0, ..., 1}, we obtain

n = −√

Kap2K5

cosϕ5. (B.43)

Thus, we can trasform (B.36) into

K ′5

K5=

J ′5

J5(for n = 0), J5 = J ′

5 = 0 (for n = 0). (B.44)

Let us then prove that the expressions (B.41) and (B.44) are equivalent to the existence of 0 ≤ ζ ≤ 1, 0 ≤ ζA ≤ 1,

0 ≤ ζB ≤ 1 and 0 ≤ ζC ≤ 1, which satisfy (B.12). To show this, we only have to define ζ, ζA, ζB and ζC as

follows:

ζA =KBCτ ′

ABC

K ′BCτABC

, ζB =KACτ ′

ABC

K ′ACτABC

, ζC =KABfτ ′

ABC

K ′ABτABC

, (B.45)

ζ =τ ′ABC

τABCζAζBζC. (B.46)

Because of (B.44), (B.45) and (B.46), the parameters ζ, ζA, ζB and ζC satisfy (B.12). Because of (B.41), the

parameters ζA, ζB and ζC are less than or equal to one. Because of (B.45) and (B.46), the parameters ζA,

ζB and ζC are greater than or equal to zero. Thus, the expressions (B.34) and (B.36) are equivalent to the

condition 1 of Theorem 11, except for ζlower ≤ ζ ≤ 1.

Now we have proven that the equations (B.34) and (B.36), which are the ones on the parameters {ci} and

n, are equivalent to the condition 1 of Theorem 11 except for ζlower ≤ ζ ≤ 1. Next, let us prove that the

condition on the parameter s is equivalent to the inequality ζlower ≤ ζ ≤ 1 and the condition 2 of Theorem

11. Hereafter, we assume the condition 1 of Theorem 11 except for ζlower ≤ ζ ≤ 1 until the end of Case A.

The condition on s is (B.35) for z = ±1 but is left out for z = ±1. First, we prove that the equation z = ±1 is

equivalent to (B.14). Because of (B.38), we can transform z = ±1 into

z = ±1 ⇔ (ϕ5 = 0, π) ∧(√

KABKAC

2λ20

√KBC

= 1)

(B.47)

⇔ (Jap sin2 ϕ5 = 0) ∧

( √Kap

K5 ±√

∆J

= 1

)(B.48)

⇔ (Jap sin2 ϕ5 = 0) ∧ (∆J = 0) (B.49)

⇔ (Jap − J25 = 0) ∧ (∆J = 0). (B.50)

where the double sign ± in (B.48) is the one in (B.22); note that the possible two sets of {λi, ϕ|i = 0, ..., 1} are

{λ+i , ϕ+|i = 0, ..., 1} and {λ−

i , ϕ−|i = 0, ..., 1} or {λ−i , ϕ−|i = 0, ..., 1} and {λ+

i , ϕ+|i = 0, ..., 1}.

Thus, the equation z = ±1 is equivalent to (B.14). In other words, Eq. (B.14) does not hold for z = ±1.

Let us next prove that the condition on s is equivalent to the condition 2 of Theorem 11 and ζlower ≤ ζ ≤ 1

in the case z = ±1. In this case, what we have to prove is that (B.35) is equivalent to the condition 2 of Theorem

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11 and ζlower ≤ ζ ≤ 1. In this case, (B.14) does not hold, and thus |ψ⟩ is ζ-definite. Hence, we only have to

prove that (B.35) is equivalent to (B.15). (Note that ζlower ≤ ζ ≤ 1.) To prove the equivalence of (B.35) and

(B.15), we first express s in terms of the K-parameters. When Qe = 0, by substituting (B.27) and (B.40) into

(B.35), we obtain

s = −√

KapQe

√∆J

sinϕ5. (B.51)

Because of (B.39) and (B.51),

Q′e√

∆J

Qe√

∆′J

√J ′ap sinϕ′

5√Jap sinϕ5

= 1 (B.52)

always holds. Substituting ∆J = K25 −Kap, Jap sin2 ϕ5 = Jap − J2

5 and (B.12) into (B.52) and reducing it, we

can obtain Qe = Q′e and ζ = ζ. Thus, when Qe = 0, (B.15) is equivalent to (B.35).

Now we consider the case where z = ±1, and thus when Qe = 0, only one of the expressions sinϕ5 = 0 and

∆J = 0 holds. When sinϕ5 = 0 holds, the equation (B.35) is equivalent to s = s′ = 0. When ∆J = 0 holds,

the equation (B.35) is equivalent to s = s′ = ∞. Because of (B.37) and (B.38), the equations s = s′ = 0 and

s = s′ = ∞ are equivalent to sinϕ5 = sinϕ′5 = 0 and ∆J = ∆′

J = 0, respectively. Because of (Qe = 0) ⇔((sinϕ5 = 0) ∨ (∆J = 0)), ∆J = K2

5 − Kap, Jap sin2 ϕ5 = Jap − J25 and (B.12), when the equation sinϕ5 = 0

holds, the equation sinϕ5 = sinϕ′5 = 0 is equivalent to (B.15). In the same manner, when the equation ∆J = 0

holds, ∆J = ∆′J = 0 is equivalent to (B.15). Thus, when Qe = 0, the expression (B.15) is equivalent to (B.35).

We have already proven that when Qe = 0, the expression (B.15) is equivalent to (B.35). Thus, (B.15) is

equivalent to (B.35).

Finally, we consider the case z = ±1. In this case, there is no condition of s and the condition (B.14) holds.

Because of (B.14), the condition 2 of Theorem 11 becomes (B.17) in this case. Thus, we only have to prove

that (B.14) is equivalent to ζlower ≤ ζ ≤ 1 and (B.17). Because we have assumed the condition 1 of Theorem

10 except for ζlower ≤ ζ ≤ 1, we obtain the following equations:

J ′25

J ′ap=

ζlowerζ

J25

Jap, (B.53)

∆′J = (ζζAζBζC)2(K2

5 − ζKap) ≥ (ζζAζBζC)2∆J . (B.54)

The derivation of (B.53) and (B.54) is as follows:

J ′25

J ′ap=

(ζζAζBζC)2J25

ζ3ζ2Aζ2

Bζ2C(KBC − ζAτABC)(KAC − ζBτABC)(KAB − ζCτABC)

=ζlower

ζ

J25

Jap, (B.55)

∆′J = (ζζAζBζC)2K2

5 − ζ3ζ2Aζ2

Bζ2CKap

= (ζζAζBζC)2(K25 − ζKap) ≥ (ζζAζBζC)2∆J . (B.56)

By using (B.53) and (B.54), let us prove that (B.14) is equivalent to ζlower ≤ ζ ≤ 1 and (B.17). First, we

prove that (B.14) is a sufficient condition of ζlower ≤ ζ ≤ 1 and (B.17) When (B.14) is valid, the equation

J25/Jap = 1 holds. Because J ′2

5 /J ′ap = cos2 ϕ′

5 ≤ 1 is always valid, when (B.14) is valid, the inequality

ζlower ≤ ζ follows (B.53). In the same manner, when (B.14) is valid, the inequality ζ ≤ 1 follows (B.54). Then,

note that the equation J ′25 = J ′

ap holds if and only if ζ = ζlower holds, and that the equation ∆′J = 0 holds if

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and only if ζ = 1 holds. Because of (B.6), the equation Q′e = 0 holds if and only if (∆′J = 0) ∨ (J ′2

5 = J ′ap)

holds. Thus, when (B.14) is valid, Q′e = 0 if and only if ζ = ζlower or ζ = 1. In the other words, now we have

proven that (B.14) is a sufficient condition of ζlower ≤ ζ ≤ 1 and (B.17).

Let us prove that (B.14) is also a necessary condition. Because of ζlower ≤ ζ ≤ 1, (B.53), (B.54) and (B.6),

the equation |Q′e| = sgn[(1 − ζ)(ζ − ζlower)] is valid if and only if both of ∆J and J25 − Jap are zero. In the

other words, (B.14) is also a necessary condition of ζlower ≤ ζ ≤ 1 and (B.17). Thus, (B.14) is equivalent to

ζlower ≤ ζ ≤ 1 and (B.17), and thus we have completed the proof in Case A. ¤

B.3.2 Case B

In this subsection, we prove Theorem 11 in Case B, where the initial state is EP-definite and the final state is

EP-indefinite. In the proof, we will use the following two lemmas which describe how a measurement changes

entanglement.

Lemma 16. Let us consider the situation where a measurement {M(i)} is performed on the qubit A of an

arbitrary three-qubit state |ψ⟩. The state∣∣ψ(i)

⟩≡ M(i) |ψ⟩ /

√p(i) is obtained as the i-th result with the probability

p(i). Then, the following equations are valid:

C(i)AB = α(i)CAB, C

(i)AC = α(i)CAC ,

√τ

(i)ABC = α(i)√τABC , (B.57)

p(i)C(i)BC = |k(i)

√τABCei(θ(i)+ϕ5) − CBCb(i)|, (B.58)

p(i) = λ20a(i) + (1 − λ2

0)b(i) + 2λ0λ1k(i) cos (θ(i) − ϕ). (B.59)

where C(i)AB, C

(i)AC , C

(i)BC and τ

(i)ABC are the concurrences and the tangle of the state

∣∣ψ(i)⟩

and

M†(i)M(i) ≡

a(i) k(i)e−iθ(i)

k(i)eiθ(i) b(i)

, (B.60)

a(i)b(i) − k2(i) ≥ 0, a(i) ≥ 0, b(i) ≥ 0, k(i) ≥ 0, 0 ≤ θ(i) ≤ 2π, (B.61)

α(i) ≡

√a(i)b(i) − k2

(i)

p(i). (B.62)

Proof : When we perform a transformation which is expressed as

M =

M00 M01

M10 M11

, M00, M01,M10,M11 ∈ C, (B.63)

on the qubit A of a pure state (B.1), the state |ψ⟩ is transformed into

M |ψ⟩ = (λ0M00 |0⟩ + λ0M10 |1⟩ + λ1eiϕM01 |0⟩ + λ1e

iϕM11 |1⟩) |00⟩

+λ2(M01 |0⟩ + M11 |1⟩) |01⟩ + λ3(M01 |0⟩ + M11 |1⟩) |10⟩ + λ4(M01 |0⟩ + M11 |1⟩) |11⟩ . (B.64)

We can transform (B.64) into the form of the generalized Schmidt decomposition (B.1) with straightforward

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algebra;

M |ψ⟩ =λ0 det

√M†M√

|M01|2 + |M11|2|000⟩ +

λ0(M00M∗01 + M10M

∗11) + λ1e

iϕ(|M01|2 + |M11|2)√|M01|2 + |M11|2

|100⟩

+√|M01|2 + |M11|2(λ2 |101⟩ + λ3 |110⟩ + λ4 |111⟩). (B.65)

Note that each coefficient of the generalized Schmidt decomposition (B.65) of M |ψ⟩ above is expressed by the

components of M†M solely:

M†M =

|M00|2 + |M10|2 M∗00M01 + M∗

10M11

M∗01M00 + M∗

11M10 |M01|2 + |M11|2

. (B.66)

Then expressing the components of M†(i)M(i) as in (B.60), we can also express M(i) |ψ⟩ and p(i) as

M(i) |ψ⟩ =λ0

√a(i)b(i) − k2

(i)√b(i)

|000⟩ +λ0k(i)e

iθ(i) + λ1eiϕb(i)√

b(i)

|100⟩

+λ2

√b(i) |101⟩ + λ3

√b(i) |110⟩ + λ4

√b(i) |111⟩ . (B.67)

p(i) = ⟨ψ|M†(i)M(i) |ψ⟩

= λ20a(i) + (1 − λ2

0)b(i) + 2λ0λ1k(i) cos (θ(i) − ϕ). (B.68)

Because of∣∣ψ(i)

⟩= M(i) |ψ⟩ /

√p(i), we can express the coefficients of the generalized Schmidt decomposition

{λ(i)|k = 0, ..., 4} as

λ(i)0 =

λ0

√a(i)b(i) − k2

(i)

√p(i)

√b(i)

, (B.69)

λ(i)1 eiϕ(i)

=λ0k(i)e

iθ(i) + λ1eiϕb(i)

√p(i)

√b(i)

, (B.70)

λ(i)2 =

λ2

√b(i)

√p(i)

, λ(i)3 =

λ3

√b(i)

√p(i)

, λ(i)4 =

λ4

√b(i)

√p(i)

. (B.71)

Because of (B.2), (B.3) and (B.69)–(B.71), the equations (B.57) and (B.58) are valid. ¤

Lemma 17. Let the notation {M(i)|i = 1, 2} stand for an arbitrary two-choice measurement which is operated

on the qubit A of a three-qubit pure state |ψABC⟩. We refer to each result of the measurements {M(i)|i = 1, 2}as

∣∣∣ψ(i)ABC

⟩. Let the notations (CAB,CAC ,CBC ,τABC ,J5,Qe) and (C(i)

AB,C(i)AC ,C(i)

BC ,τ (i)ABC ,J (i)

5 ,Q(i)e ) stand for the

sets of the C-parameters of the states |ψABC⟩ and∣∣∣ψ(i)

ABC

⟩, respectively. Then, the following inequalities hold:

CBC ≤1∑

i=0

p(i)C(i)BC ≤

√√√√√C2BC +

1 −

(1∑

k=0

p(i)α(i)

)2 τABC , (B.72)

where the probability p(i) and the multiplication factor α(i) are defined in (B.59) and (B.62), respectively.

Proof : The average∑1

i=0 p(i)C(i)BC is equal to the length of the heavy line in Fig. B.5, because we can

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π−θ(0)−ϕ5

b(1)CBCb(0)CBC

p(0)C(0)

BC p(1)C(1)

BC

k(0) τABC

Q

SR

~θ(0)+ϕ5

~

Figure B.5: A geometric interpretation of the change of CBC .

interpret (B.58) as the cosine theorem and because b(0) + b(1) = 1 and∑

i k(i) = 0. The end points of the heavy

line have to coincide with the end points of the segment RS because∑

i k(i) = 0. Then, the left inequality

CBC ≤∑2

i=1 piC(i)BC clearly holds, since a polygonal line is longer than a straight line.

To prove the right inequality of this Lemma, it suffices to show the inequality

√(bCBC + k cos θ

√τABC)2 + (k sin θ

√τABC)2

+√

[(1 − b)CBC − k cos θ√

τABC ]2 + (k sin θ√

τABC)2

≤√

C2BC + {1 − [

√ab − k2 +

√(1 − a)(1 − b) − k2]2}τABC (B.73)

under the conditions ab − k2 ≥ 0, (1 − a)(1 − b) − k2 ≥ 0, 0 ≤ θ ≤ 2π, 0 ≤ a ≤ 1 and 0 ≤ b ≤ 1, where we used

the substitutions:

a(0) = a, a(1) = 1 − a, b(0) = b, b(1) = 1 − b, θ(0) + ϕ5 = π − θ. (B.74)

The fact that θ can take any value guarantees the last substitution.

Let us find maximum value of the left-hand side of (B.73) with the values of the measurement parameters

a, b and k fixed. We can express the left-hand side of (B.73) as

√u2 + w2 + 2uw cos θ +

√v2 + w2 − 2vw cos θ, (B.75)

where u = bCBC , v = (1 − b)CBC and w = k√

τABC . With the values of u, v and w fixed, the quantity

(B.75) is maximized to be (u + v)√

1 + w2/(uv) at the point cos θ = w(u − v)/2uv. Substituting u = bCBC ,

v = (1 − b)CBC and w = k√

τABC give that

the maximum of the left-hand side of (B.73) =

√C2

BC +k2τABC

b(1 − b). (B.76)

Hence, in order to prove Lemma 17, it suffices to show

k2

b(1 − b)≤ 1 − [

√ab − k2 +

√(1 − a)(1 − b) − k2]2. (B.77)

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After straightforward algebra, (B.77) is reduced to

[(a − b) + k2 (b2 − (1 − b)2)

b(1 − b)

]2

≥ 0. (B.78)

Hence we have proved the right inequality of (B.72) and thereby completed the proof of Lemma 17.¤

Note that Lemma has the following corollary:

0 ≤∑

i

p(i)αi ≤ 1. (B.79)

Now we have completed the preparation. Let us start the proof of Theorem 11 in Case B. In the present

Case, the final state is EP-indefinite, and thus we can neglect the condition 2 of Theorem 11. Thus, we only

have to show that the condition 1 of Theorem 10 is a necessary and sufficient condition of the possibility of a

d-LOCC transformation.

Let us prove that a d-LOCC transformation from |ψ⟩ to |ψ′⟩ is executable if |ψ⟩ and |ψ′⟩ satisfy the condition

1 of Theorem 11. First we prove that if |ψ⟩ and |ψ′⟩ satisfy the condition 1 of Theorem 11, the state |ψ′⟩ is

biseparable or full-separable. Because |ψ⟩ is EP-definite and because of (B.9),

KAB > τABC , KAB > τABC , KBC > τABC . (B.80)

Because |ψ′⟩ is EP-indefinite, at least one of

K ′AB = τ ′

ABC , K ′AB = τ ′

ABC , K ′BC = τ ′

ABC (B.81)

holds. We can assume K ′AB = τ ′

ABC without losing generality. Because of (B.80), K ′AB = τ ′

ABC and the

condition 1 of Theorem 11, at least one of ζ, ζA, ζB is zero. When only one of ζA and ζB is zero and ζ is not

zero, the state |ψ′⟩ is biseparable; only K ′BC or K ′

AC is not zero. When both of ζA and ζB are zero or ζ is zero,

the state |ψ′⟩ is full-separable; all of the K-parameters of |ψ′⟩ are zero. Now we have proven that if |ψ⟩ and

|ψ′⟩ satisfy the condition 1 of Theorem 11, the state |ψ′⟩ is biseparable or full-separable.

Next, let us prove that if |ψ⟩ and |ψ′⟩ satisfy the condition 1 of Theorem 11, there is an executable d-

LOCC transformation from |ψ⟩ to |ψ′⟩. Now the state |ψ′⟩ is biseparable or full-separable. Without losing

generality, we can assume that C ′BC is the only nonzero parameter in (C ′

AB , C ′AC , C ′

BC , τ ′ABC , J ′

5, Q′e). Because

|ψ⟩ and |ψ′⟩ satisfy the condition 1 of Theorem 11, the inequality C ′2BC ≤ KBC holds. The set of full-separable

states and biseparable states which have the same kind of bipartite entanglement is a totally ordered set

[69]. In other words, when two states |ψ⟩ and |ψ′⟩ belong to such a set, there is an executable deterministic

LOCC transformation from the EP-definite state |ψ⟩ to the EP-indefinite state |ψ′⟩ if and only if the bipartite

entanglement of the state |ψ⟩ is greater than or equal to that of the state |ψ′⟩. Thus, if there is the following

measurement {M(i)}, there is an executable d-LOCC transformation from |ψ⟩ to |ψ′⟩; a measurement whose

results can be transformed into a unique state |ψ′′⟩ by local unitary operations without exception, where |ψ′′⟩is a biseparable state whose C2

BC is equal to KBC of |ψ⟩. The measurement {M(i)} is given as follows:

M†(0)M(0) =

a(0) k(0)e−iθ(0)

k(0)eiθ(0) b(0)

=

a ke−iθ

keiθ b

, (B.82)

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M†(1)M(1) =

a(1) k(1)e−iθ(1)

k(1)eiθ(1) b(1)

=

1 − a −ke−iθ

−keiθ 1 − b

, (B.83)

where the measurement parameters a, b, k and θ are defined as follows:

a =12− λ1 sin ϕ

2√

λ21 sin2 ϕ + λ2

0

, (B.84)

b =12

+λ1 sinϕ

2√

λ21 sin2 ϕ + λ2

0

, (B.85)

k =λ0

2√

λ21 sin2 ϕ + λ2

0

, (B.86)

θ =π

2. (B.87)

With substituting (B.84)–(B.87) into (B.57) and (B.58) and after straightforward algebra, we can confirm that

the measurement {M(i)} is the measurement that we sought. Thus, we have proven that the condition 1 of

Theorem 11 is a sufficient condition for the existence of an executable d-LOCC transformation.

Next, let us prove that the condition 1 of Theorem 11 is also a necessary condition. In other words,

we prove that if there is an executable d-LOCC transformation from |ψ⟩ to |ψ′⟩, the states |ψ⟩ and |ψ′⟩must satisfy the condition 1 of Theorem 11. It is possible to substitute two-choice measurements for any

measurements of an LOCC transformation on a three-qubit pure state [67]. Hereafter, unless specified otherwise,

measurements of LOCC transformations will be two-choice measurements. First, we prove that a deterministic

LOCC transformation from an EP-definite state to an EP-indefinite state is executable only if the final state is

biseparable or full-separable. We prove Lemma 18, which generally holds for stochastic LOCC transformation

including d-LOCC transformations.

Lemma 18. Let the notation TSL stand for an LOCC transformation from an arbitrary EP-definite state |ψ⟩to arbitrary EP-indefinite states {

∣∣ψ(i)⟩}. The subscript SL stands for stochastic LOCC. Then, if this LOCC

transformation TSL is executable, there must be full-separable states or biseparable states in the set {∣∣ψ(i)

⟩}.

Proof : We prove the present lemma by mathematical induction with respect to N , which is the number of

times measurements are performed in the LOCC transformation TSL. Let us define how to count the number of

times of the measurement. Let the notation T stands for an arbitrary LOCC transformation. We fix the order of

measurements in the LOCC transformation T cyclically: If the first measurement of the LOCC transformation

T is performed on the qubit A, the second one is on the qubit B, the third one is on the qubit C, the fourth

one returns to the qubit A, and so on. If the first measurement is performed on the qubit B, the second one

is on the qubit C, and so on. We can attain such a fixed order by inserting the identity transformation as a

measurement. The LOCC transformation T may have branches and the numbers of times the measurements

are performed may be different in different branches. We refer to the largest of the numbers as the number N .

We can make the number of each branch equal to N by inserting the identity transformations. An example is

given in Fig. B.6. We use this counting procedure in the proofs of other theorems, too.

Let the notations (CAB , CAC , CBC , τABC , J5, Qe) and (C(i)AB , C

(i)AC , C

(i)BC , τ

(i)ABC , J

(i)5 , Q

(i)e ) stand for the sets

of the C-parameters of the EP-definite state |ψ⟩ and the EP-indefinite states∣∣ψ(i)

⟩, respectively.

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M1 on A

result 1

result 0M2 on B

M3 on C

result 1

result 1

result 0

result 0

final

final

final

final

Insert identity transformations

M1 on A

result 1

result 0

M2 on B

M3 on C

result 1

result 1

result 0

result 0

final

final

final

final

I on B

I on C

I on C

Figure B.6: The method of counting the number N . In this figure, M1, M2 and M3 denote measurements andI denotes the identity transformation. The number N is 3 in this example.

First, we prove the present lemma for N = 1. Because of the arbitrariness of the state |ψ⟩, we can assume

that the first measurement {M(i)|i = 0, 1} of the LOCC transformation TSL is performed on the qubit A without

loss of generality. Thus, the operator M(i) makes CAB , CAC and√

τABC evenly multiplied by a real number

α(i). The state |ψ⟩ is EP definite, and hence CAB , CAC and CBC are all positive. Because the state∣∣ψ(i)

⟩is EP indefinite, at least one of C

(i)AB , C

(i)AC and C

(i)BC has to be zero for all i. When C

(i)AB or C

(i)AC is zero, the

multiplication factor α(i) must be zero, and therefore all of C(i)AB , C

(i)AC and τ

(i)ABC must be zero. Then, the

parameter J(i)5 also must be zero because of C

(i)ABC

(i)ACC

(i)BC = 0. Thus, in the case of C

(i)AB = 0 or C

(i)AC = 0, the

EP-indefinite state∣∣ψ(i)

⟩is a full-separable state with C

(i)BC = 0 or a biseparable state with C

(i)BC = 0. Hence, if

there were neither a full-separable state nor a biseparable state in the set of EP-indefinite states {∣∣ψ(i)

⟩}, the

expressions C(i)AC = 0, C

(i)AB = 0 and C

(i)BC = 0 would hold for all i. Because of Lemma 17, however, at least one

of C(0)BC and C

(1)BC would be greater than or equal to CBC , which is positive. This is a contradiction, and thus

the expression C(i)BC = 0 has to hold for at least one of i. We have thereby shown the present lemma for N = 1.

Now, we prove Lemma 18 for N = k + 1, assuming that Lemma 18 holds whenever 1 ≤ N ≤ k. Let us

assume that the number of times of measurements in the LOCC transformation TSL from the EP-definite state

|ψ⟩ to the EP-indefinite states {∣∣ψ(i)

⟩} is k + 1. Because of the assumption for 1 ≤ N ≤ k, the situation before

the last measurement has to be either of the following two situations:

(i) All states are already EP indefinite, and there are full-separable states or biseparable states among them.

(ii) Some states are EP definite.

In the case of (i), there are full-separable states or biseparable states in the final EP-indefinite states {∣∣ψ(i)

⟩}

because an arbitrary full-separable state or an arbitrary biseparable state can be transformed only into full-

separable states or biseparable states by a measurement.

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In the case of (ii), if there were neither a full-separable state nor a biseparable state in the EP-indefinite states

{∣∣ψ(i)

⟩}, there would have to be a measurement which could transform an EP-definite state to EP-indefinite

states which are neither full-separable states nor biseparable states. Because of the theorem for N = 1, this is

impossible.

Therefore, there must be either full-separable states or biseparable states in the EP-indefinite states {∣∣ψ(i)

⟩}

in the case (ii) as well as in the case (i). This completes the proof of Lemma 18. ¤

Because of Lemma 18, if a d-LOCC from an EP-definite state |ψ⟩ to an EP-indefinite state |ψ′⟩ is executable,

then |ψ′⟩ is biseparable or full-separable. Without losing generality, we can assume that the only nonzero

parameter in the K-parameters of |ψ′⟩ is K ′BC . To show the K-parameters of   |ψ⟩ and |ψ′⟩ satisfy the

condition 1 of Theorem 11, it is sufficient to prove the inequality K ′BC ≤ KBC . To prove K ′

BC ≤ KBC , we

prove the following Lemma 19.

Lemma 19. Let the notation {M(i)|i = 0, 1} stand for an arbitrary two-choice measurement which is operated

on a qubit of a three-qubit pure state |ψABC⟩. Note that we can operate {M(i)|i = 0, 1} on any one of the qubits

A, B and C of the state |ψABC⟩. We refer to each result of {M(i)|i = 0, 1} as∣∣∣ψ(i)

ABC

⟩. Let the notations

(KAB,KAC ,KBC ,τABC ,J5,Qe) and (K(i)AB,K(i)

AC ,K(i)BC ,τ (i)

ABC ,J (i)5 ,Q(i)

e ) stand for the sets of the K-parameters of

the states |ψABC⟩ and∣∣∣ψ(i)

ABC

⟩, respectively. Then, the following inequality holds:

1∑i=0

p(i)

√K

(i)BC ≤

√KBC . (B.88)

Proof : First, we prove (B.88) in the case where the measurement {M(i)|i = 0, 1} is performed on the qubit

B or C. In this case C(i)BC = α(i)CBC and

√τ

(i)ABC = α(i)√τABC , where α(i) is the multiplication factor of the

measurement {M(i)|i = 0, 1}. Thus, because of (B.79), we can obtain (B.88) as follows:

1∑i=0

p(i)

√K

(i)BC =

1∑i=0

p(i)

√(C(i)

BC)2 + τ(i)ABC =

1∑i=0

p(i)α(i)

√C2

BC + τABC ≤√

KBC . (B.89)

Now, it suffices to prove (B.88) in the case where the first measurement is performed on the qubit A. Let

the notation f stand for the left-hand side of (B.88). Because of Lemma 16 we obtain

f =√

b2C2BC + 2bk cos θCBC

√τABC + abτABC (B.90)

+√

(1 − b)2C2BC − 2(1 − b)k cos θCBC

√τABC + (1 − a)(1 − b)τABC ,

where we substitute θ for the phase π − θ − ϕ5, because the range of the phase θ is from 0 to 2π. When

2k cos θCBC = (b − a)√

τABC , the function f is maximized to√

KBC . Thus, (B.88) holds. ¤The inequality (B.88) includes K ′

BC ≤ KBC , if the number N of times measurements of a d-LOCC transfor-

mation from |ψ⟩ to |ψ′⟩ is equal to 1. Let us assume that K ′BC ≤ KBC also holds whenever 1 ≤ N ≤ k. Then,

when N = k + 1, the inequality K ′BC ≤ KBC also holds; (Proof : Let the notion {

∣∣ψ′(i)⟩} stand for results of

the first measurement the d-LOCC transformation. We refer to the parameter KBC of∣∣ψ′(i)⟩ as K

′(i)BC . Note

that the LOCC transformations from∣∣ψ′(i)⟩ to |ψ′⟩ are d-LOCC transformations whose the number of times

measurements are less than or equal to k. Thus, the inequalities K ′BC ≤ K

′(i)BC hold for all of K

′(i)BC , and thus

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the inequality K ′BC ≤ KBC also holds. ¤) Hence, now we have completed the proof of Theorem 11 in Case B.

B.3.3 Case C

In this subsection, we prove Main Theorems in Case C, where the initial state is EP-indefinite and GHZ-type.

First, we consider the case in which the final state is EP-definite. In this case, the final state is truly

multipartite. We cannot achieve a W-type state from a GHZ-type state with an LOCC transformation [67].

Thus, the final state must be a GHZ-type state too. We have already proven that if the initial and final states

satisfy the two conditions of Theorem 11, the final state must be GHZ-type. Thus, we only have to consider

the case in which both initial and final states are GHZ-type. A d-LOCC transformation from a GHZ-type state

whose coefficient set {ci} has a zero to a GHZ-type state whose coefficient set {ci} has no zeros is executable if

and only if

c′i ≥ ci (k = A,B,C), (B.91)

|z| = 1, (B.92)

z′ is purely imaginary, (B.93)

where {ci} and z are defined in (B.31) [68]. Because of (B.39), a GHZ-type state is EP-definite if and only if

its coefficient set {ci} has no zeros. Thus, in the present case where the final state is EP-definite, we only have

to prove that (B.91)–(B.93) are equivalent to the two conditions of Theorem 11.

Let us prove the equivalence between (B.91)–(B.93) are the two conditions of Theorem 11. Because of (B.38)

and (B.39), the expressions (B.91)–(B.93) are equivalent to

τ ′ABC

τABC≤ K ′

AB

KAB,

τ ′ABC

τABC≤ K ′

AC

KAC,

τ ′ABC

τABC≤ K ′

BC

KBC, (B.94)

√KABKAC

2λ20

√KBC

=

√Kap

K5 ±√

∆J

= 1, (B.95)

ϕ5 = ±π

2, (B.96)

where the double sign ± in (B.95) is the one in (B.22); note that the possible two sets of {λi, ϕ|i = 0, ..., 1}are {λ+

i , ϕ+|i = 0, ..., 1} and {λ−i , ϕ−|i = 0, ..., 1} or {λ−

i , ϕ−|i = 0, ..., 1} and {λ+i , ϕ+|i = 0, ..., 1}. Because

(B.95) is valid in either case of the multiple signs, the parameter ∆J is zero. Because of ∆J = K25 −Kap, when

∆J = 0 holds, (B.95) also holds. Thus, (B.95) is equivalent to ∆J = 0. Because of√

Jap cos ϕ5 = J5, (B.96)

is equivalent to J5 = Jap = 0. Thus, (B.95) and (B.96) are equivalent to (B.14). We have already proven that

(B.14) is equivalent to ζlower ≤ ζ ≤ 1 and (B.17) in the section B.3.1. Thus, we only have to prove that (B.94)

is equivalent to the existence of ζ, 0 ≤ ζA ≤ 1, 0 ≤ ζB ≤ 1 and 0 ≤ ζC ≤ 1, which satisfy (B.12). We can

define such ζ–ζC as (B.45) and (B.46). Thus, in the case where the final state is EP-definite, the conditions of

Theorem 11 is a necessary and sufficient condition of d-LOCC.

Second, we consider the case where the final state is EP-indefinite and GHZ-type. Because a GHZ-type

state is EP-definite if and only if its coefficient set {ci} has no zeros, in this case, a d-LOCC transformation is

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executable if and only if

c′i ≥ ci (k = A,B,C), (B.97)

|z′| ≥ |z|, (B.98)

where {ci} and z are defined in (B.31), and where we choose z and z′ such that |z| ≥ 1 and |z′| ≥ 1 [68].

Let us prove that (B.97) and (B.98) are equivalent to the condition 1 of Theroem 2. Because of (B.22),

(B.38), |z′| ≥ 1 and |z| ≥ 1,

|z| =

√Kap

K5 −√

∆J

, |z′| =

√K ′ap

K ′5 −

√∆′

J

. (B.99)

Because of (B.39), (B.97) is equivalent (B.94). Because both of the initial and final states are EP-indefinite,

J5 = J ′5 = 0 is valid. Thus, we can define ζlower ≤ ζ ≤ 1, 0 ≤ ζA ≤ 1, 0 ≤ ζB ≤ 1 and 0 ≤ ζC ≤ 1, which

satisfy (B.12) as (B.45) and (B.46). Thus, in the case where the final state is EP-indefinite and GHZ-type, the

conditions of Theorem 11 is a necessary and sufficient condition of d-LOCC.

Third, we consider the case where the final state is EP-indefinite but not GHZ-type. In this case, the final

state is biseparable or full-separable. Because the final state is not EP-definite, the condition 2 of Theorem

11 is left out; we only have to consider the condition 1. When the final state is full-separable, a d-LOCC

transformation to the final state is clearly executable, and the initial and final states clearly satisfy the condition

1 of Theorem 11: ζA = ζB = ζC = 0 satisfy (B.12). Thus, we only have to consider the case the final state is

biseparable.

Let us prove the condition 1 of Theorem 11 is a necessary condition of the possibility of the d-LOCC

transformation. Without loss of generality, we can assume that the only nonzero K-parameter of the final state

is K ′BC . Because of Lemma 19, we can prove the inequality K ′

BC ≤ KBC , in the same manner as K ′BC ≤ KBC

is shown in Case B. Thus, if a d-LOCC transformation is executable, the initial and final states satisfy the

condition 1 of Theorem 11. In other words, the condition 1 of Theorem 11 is a necessary condition of the

possibility of the d-LOCC transformation.

Finally, let us prove the condition 1 of Theorem 11 is a sufficient condition of the possibility of the d-LOCC

transformation. Without loss of generality, we can assume that the only nonzero K-parameter of the final

state is K ′BC . The upper limit of K ′

BC is KBC . We can realize this upper limit by the measurement {M(i)}which is defined as (B.82)–(B.87). According to Ref. [69], the set of full-separable states and biseparable states

which have the same kind of bipartite entanglement is a totally ordered set. Thus, in this case, a d-LOCC

transformation from |ψ⟩ to |ψ′⟩ is executable if and only if K ′BC ≤ KBC . Thus, in the case where the final state

is EP-indefinite and not GHZ-type, the conditions of Theorem 11 is a necessary and sufficient condition of the

possibility of d-LOCC transformation. ¤

B.3.4 Case D

In this subsection, we prove Theorem 10 in Case D, where the tangle of the initial state is zero.

First, we simplify (B.12). Let us show that we can leave τABC , J5 and Qe out of the discussion hereafter.

First, τ ′ABC = 0 follows from τABC = 0, because an arbitrary measurement makes the tangle τABC only multi-

plied by a constant. Next, because of (B.2)–(B.4) and the equation τABC = 0, the equation J5 = CABCACCBC

holds. (Proof : Because of (B.3) and τABC = 0, at least one of λ0 and λ4 is zero. When λ0 is zero, the

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equations J5 = CABCACCBC = 0 hold. Thus λ4 is zero, and then J5 = CABCACCBC = 4λ20λ

22λ

23 follows (B.2)

and (B.4).¤) Thus, in order to examine the change of J5, it suffices to examine the change of the concurrences

CAB , CAC and CBC .

Next, because of τABC = 0 ⇔ λ0 = 0 ∨ λ4 = 0 and because if there is a zero in {λk|k = 0, ..., 4} then

sinϕ = 0, the equation Qe = 0 follows (B.6). In the same manner, the entanglement charge Q′e is also zero

because of τ ′ABC = 0. Thus, Qe = Q′

e = 0 holds. Condition 2 of Theorem 11 satisfies this equation. Let us

show this. The state |ψ⟩ is ζ-indefinite, because τABC = 0:

∆J = K25 − Kap = J2

5 − Jap = C2ABC2

ACC2BC sin2 ϕ5

= 4C2ABC2

ACλ21λ

24 sin2 ϕ = 0, (B.100)

where we use sin ϕ = 0. Note that sin ϕ = 0 holds when there is a zero in {λi|i = 0, ..., 4} and that τABC =

λ0λ4 = 0. Because the state |ψ⟩ is ζ-indefinite, Condition 2 is reduced to |Q′e| = sgn[(1 − ζ)(ζ − ζlower)].

Incidentally, because of τABC = 0, ζlower = 1 holds. Thus, ζ = 1 follows ζlower ≤ ζ ≤ 1, and thus Condition

2 satisfies the equation Q′e = 0. In order to prove the present theorem, it suffices to show that a necessary and

sufficient condition is that there are real numbers αA, αB and αC which are from zero to one and which satisfy

the following equation: C ′2

AB

C ′2AC

C ′2BC

=

α2

Aα2B

α2Aα2

C

α2Bα2

C

C2AB

C2AC

C2BC

. (B.101)

Note that (B.101), J5 = CABCACCBC and J ′5 = C ′

ABC ′ACC ′

BC give J ′5 = α2

Aα2Bα2

CJ5, and that τABC = 0 ⇒(KAB = C2

AB) ∧ (KAC = C2AC) ∧ (KBC = C2

BC).

We can classify the sets of the initial and final states as follows:

Case D-1: At least one of the concurrences CAB , CBC and CAC is zero.

Case D-2: None of the concurrences CAB , CBC and CAC is zero, and at least one of the concurrences C ′AB ,

C ′BC and C ′

AC is zero.

Case D-3: All of the concurrences CAB , CBC , CAC , C ′AB, C ′

BC and C ′AC are nonzero.

Note that we already have τABC = τ ′ABC in the present Case D.

In Case D-1, we first note that only the biseparable states are allowed as the initial states in this case.

The set of full-separable states and biseparable states which have the same kinds of bipartite entanglements

is a totally ordered set [69]. We cannot transform a full-separable state or a biseparable state into other type

states with LOCC transformations [67], and thus we can derive the necessary and sufficient condition, which

reduces to the following: there is an executable deterministic LOCC transformation from |ψ⟩ to |ψ′⟩ if and only

if CAC ≥ C ′AC . This condition is equivalent to (B.101) in Case D-1.

In Case D-2, where none of CAB , CBC and CAC is zero and at least one of C ′AB , C ′

BC and C ′AC is zero, the

initial state is EP definite while the final state is EP indefinite. Thus, Case B includes Case D-2, and thus the

existence of αA, αB and αC which satisfy (B.101) is the necessary and sufficient condition.

In Case D-3, where all of the concurrences CAB , CBC , CAC , C ′AB , C ′

BC and C ′AC are nonzero, the initial and

final states are W-type states. In the present case, we can use the result of Ref. [70]. A d-LOCC transformation

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from a W-type state |ψ⟩ to another W-type state |ψ′⟩ is possible if and only if

xi ≥ x′i (i = 1, 2, 3), (B.102)

where the sets of positive real numbers {xi} and {x′i} are defined by the decompositions of |ψ⟩ and |ψ′⟩ [70]:

|ψ⟩ = x0 |000⟩ + x1 |100⟩ + x2 |010⟩ + x3 |001⟩ , (B.103)

|ψ′⟩ = x′0 |000⟩ + x′

1 |100⟩ + x′2 |010⟩ + x′

3 |001⟩ . (B.104)

Note that we can reduce (B.103) into a generalized Schmidt decomposition

|ψ⟩ = x1 |000⟩ + x0 |100⟩ + x3 |101⟩ + x2 |110⟩ (B.105)

with transformation |0A⟩ ↔ |1A⟩. We thereby obtain

2x1x2 = CAB , 2x1x3 = CAC , 2x2x3 = CBC , (B.106)

x1 =√

CABCAC

2CBC, x2 =

√CABCBC

2CAC, x1 =

√CACCBC

2CAB. (B.107)

Thus, the existence of αA, αB and αC which are from zero to one which satisfy (B.101) is equivalent to the

existence αA, αB and αC which are from zero to one which satisfy

αA = x′1/x1, αB = x′

2/x2, αC = x′3/x3. (B.108)

Note that when αA, αB and αC are from 0 to 1, (B.108) is equivalent to (B.102). Thus, (B.101) is a necessary

and sufficient condition of d-LOCC in Case D-3. ¤We thereby have completed the proof of Theorem 11 in all cases.

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Appendix C

Thermodynamical derivation of (4.7)

In the present appendix, we derive the inequality (4.7) in the thermodynamical way. Hereafter, we treat the

working body S, and the hot heat bath BH , and the cold heat bath BL as the finite-size thermodynamic systems.

We express the equiliburium states of S, BH and BL as (US , XS), (UBH, XBH

) and (UBL, XBL

), where U is the

internal energy and X is the set of other thermodynamic variables. Initially, the systems S, BH and BL are in

the equilibrium states (U iniS , X ini

S ), (U iniBH

, X iniBH

) and (U iniBL

, X iniBL

), respectively. Then, we perform an adiabatic

operation on the three systems. During the adiabatic operation, the hot bath BH loses the heat QH , and we

take the extracted work Wext. After the adiabatic operation, we wait enough time, and these three systems are

assumed to be in equilibrium states (U iniS , X ini

S ), (U iniBH

− QH , X iniBH

), and (U iniBL

+ QH − Wext, XiniBL

).

Under the above setup, let us derive an upper bound for the efficiency. Because the adiabatic transformation

does not decreases the thermodynamic entropy,

S(U iniS , X ini

S )+S(U iniBH

, X iniBH

)+S(U iniBL

, X iniBL

) ≤ S(U iniS , X ini

S )+S(U iniBH

−QH , X iniBH

)+S(U iniBL

+QH −Wext, XiniBL

)

(C.1)

holds. Because the thermodynamic entropy is an increasing function of the internal energy, we obtain

Wext ≤ QH + U iniBL

− U ′BL

(C.2)

where U ′BL

is defined by S(U iniBH

, X iniBH

) + S(U iniBL

, X iniBL

) = S(U iniBH

− QH , X iniBH

) + S(U ′BL

, X iniBL

). Thus,

η :=Wext

QH= 1 −

U ′BL

− U iniBL

QH. (C.3)

The (C.3) is equivalent to (4.7). ¤

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Acknowledgements

It is a pleasure to thank my supervisor, Prof. Naomichi Hatano for his valuable suggestions and comments,

and cheerful encouraging words. I would like to thank Prof. Masahito Hayashi for his very kind help in our

collaborations, and his helpful comments for the thesis; Prof. Hal Tasaki and Prof. Takahiro Sagawa for their

fruitful discussions about the formularization of the work extraction; Prof. Satoshi Ishizaka and Dr. Julio

de Vicente for their valuable comments about the deeterministic LOCC transformation. Moreover, I would

like to thank many researchers who have given me the opportunities of a lot of fruitful discussions. Finally, I

appreciate the members of the Hatano group for their tender supports. The present thesis work is supported

by the Grants-in-Aid for Japan Society for Promotion of Science (JSPS) Fellows (Grant No.24.8116).

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