-
2013731
25
201386
-X
RIETAN-FP
50%
1
-
-X
10%
-
2
-
AichiSR BL5S2 h = 12.4 keV = 12.398419 / 12.4 = 0.999873 1
NIST SRM674b CeO2
NIST SRM674b
ZnO, TiO2, Cr2O3, CeO2
CeO2 a = 5.4116510(59)
a = 5.43123(8) @ 22.5 C NIST SRM 640d Si
NIST SRM674b CeO2
(i) CeO2 AichiSR BL5S2
SPring-8 BL19B2
(ii) SRM674b CeO2 1 m SRM640d Si
5 m AichiSR BL5S2
(iii) Ce
(iv)
Si
BL5S2
3
-
SPring-8 BL19B2 AichiSR BL5S2
-
AtomWork RIETAN-FP VESTA
-
AichiSR BL5S2 h = 12.4 keV = 12.398419 / 12.4 = 0.999873 CeO2
NIST SRM674b
SiO2 KCl 1:1
(1) Web 20130806 AichiSR BL5S2
http://www.crl.nitech.ac.jp/~ida/topics/2013/0806AichiSR/index-j.html
(2) BL5S2 AichiSR/BL5S2
(3) PC 20130806AichiSR
CeO2
(1)
0201ceria
ceria.int CeO2
4
http://www.crl.nitech.ac.jp/~ida/topics/2013/0806AichiSR/index-j.htmlhttp://www.crl.nitech.ac.jp/~ida/topics/2013/0806AichiSR/index-j.htmlhttp://www.crl.nitech.ac.jp/~ida/topics/2013/0806AichiSR/index-j.htmlhttp://www.crl.nitech.ac.jp/~ida/topics/2013/0806AichiSR/index-j.html
-
[Ctrl]-[S]
[Ctrl]-[Z]
(2) Web BL5S2
20130522_staff_sio2_1-01.dat 2 ()
(3) Web [Ctrl]+[A] [Ctrl]+[C]
(4) ceria.int [Ctrl]+[V]
(5) RIETAN-FP
ceria.int
(6)
0
RIETAN-FP
(7) ceria.int
GENERAL$
(8) ceria.int
RIETAN-FP
(9) ceria.int
(10)Web ceria.int
(11) ceria.int
5
-
ceria.bat
ceria.ins AichiSR BL5S2
(1)ceria.int 0201Ceria ceria.bat
(2) Web RIETAN-FP ceria.bat
[Ctrl]+[A] [Ctrl]+[C]
(3) ceria.bat [Ctrl]+[V]
(4) [Ctrl]+[S] ceria.bat
(5)ceria.int
ceria.bat 0201Ceria ceria.ins
(6) Web RIETAN-FP ceria.ins [Ctrl]
+[A] [Ctrl]+[C]
(7) ceria.ins [Ctrl]+[V]
(8) [Ctrl]+[S] ceria.ins
ceria.ins
(1)
6
-
0207Quartz_KCl
quartz_KCl.int
(2) Web BL5S2
20130522_staff_sio2_1-07.dat
(3) Web [Ctrl]+[A]
[Ctrl]+[C]
(4) quartz_KCl.int [Ctrl]+[V]
(5) RIETAN-FP
quartz_KCl.int
(6)
(7) quartz_KCl.int
GENERAL$
(8) quartz_KCl.int RIETAN-FP
(9) quartz_KCl.int
(10)Web quartz_KCl.int
(11) quartz_KCl.int
quartz_KCl.bat
quartz_KCl.ins AichiSR BL5S2
(1)quartz_KCl.int
0207Quartz_KCl quartz_KCl.bat
7
-
(2) Web RIETAN-FP quartz_KCl.bat
[Ctrl]+[A] [Ctrl]+[C]
(3) quartz_KCl.bat [Ctrl]+[V]
(4) [Ctrl]+[S] quartz_KCl.bat
(5)quartz_KCl.int quartz_KCl.bat 0207Quartz_KCl
quarrtz_KCl.ins
(6) Web RIETAN-FP quartz_KCl.ins
[Ctrl]+[A] [Ctrl]+[C]
(7) quartz_KCl.ins [Ctrl]+[V]
(8) [Ctrl]+[S] quartz_KCl.ins
quartz_KCl.ins
-
CeO2
Cu
AichiSR BL5S2
IP
8
-
IP
CeO2
ceria.ins
(1) ceria.ins
(2)9
Ceria, CeO2
(3) NBEAM = 2: 12 = 2
(4) NMODE = 0: 15
(5) NPRINT = 0: 18
(6) XLMDX = 0.999873: 21 0.999873 12.4 keV
(7) PCOR2 = 0.05: 22 BL5S2
PCOR2 = 0.05
PCOR2 = 0.0
(8) CTHM2 = 1.0: 25 CTHM2 =
1.0
9
-
(9) XMUR2 = 0.0: R 26
R
XMUR2 = 0.0
(10)30
'Ce' 'O' /
(11) ff
3637
PDF
-0.351 4.740
0.020 0.013
(12) PHNAME1 = Ceria: 43 (13) VNS1 = A-225-1: 45
(14) HKLM1 = F m -3 m : 48
(15) LPAIR1 = 0: 51
(16) INDIV1 = 1: 60
(17) NSHIFT = 4: 11 23
109
(1) 142
SHIFTN 0.01 0.0 0.0 0.0 1000
0.01
(2) 145
ROUGH 0.0 0.0 0.0 0.0 0000
(3) 148150
BKGD 2300.8 -885.5 539.6 -452.9 412.1 -191.3
10
-
-359.1 45.5 53.6 -15.8 -56.9 13.9
111111111111
11
(1) 166
SCALE1 2.6E-6 1
(2) 173
FWHM1 2.0E-3 1.7E-4 2.1E-3 0.0 0000
(3) 175
ASYM1 1.0 0.0 0.0 0.0 0000
(4) 177
ETA1 0.43 0.36 0.43 0.36 0022
219
(5) 16 181182
DUMMY1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0
0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0
0000000000000000
(6) f1, r1, f2, r2, f3, r3186
PREF1 0.333333 1.0 0.333333 1.0 0.333334 1.0 000222
7585
222225 r1
11
-
(7) a, b, c, , , 186
CELLQ1 5.41165 5.41165 5.41165 90.0 90.0 90.0 0.0 1000000
(8) x, y, z
199200
Ce1/Ce 1.0 0.0 0.0 0.0 0.5 00000
O2/O 1.0 0.25 0.25 0.25 0.7 00000
(1) 218223
#
A(ETA1,3)=A(ETA1,1) ; A(ETA1,4)=A(ETA1,2)
# March-Dollase
A(PREF1,5)=1.0-A(PREF1,1)-A(PREF1,3)
#
A(PREF1,4)=A(PREF1,2) ; A(PREF1,6)=A(PREF1,2)
(2) 273
NEXC = 1: .
276277
2 {
0.0 17.0
75.0 180.0
} 2
1775
12
-
(3) 294
NINT = 1
(4) 366
PC = 50.0
PC
(5) 372
NLESQ = 0
(6) [Ctrl]+[S] ceria.ins
(1) ceria.bat
(2)RIETVIEW
(3) RIETVIEW
(4) RIETVIEW Click OK to quit the output window OK
(5) RIETAN-FP ceria.lst
13
-
(6) *.lst
R
(7) Reliability factors, ...
Reliability factors, goodness-of-fit indicator, ...
Rwp = 3.913 Rp = 3.072 RR = 60.502 ...
Ceria
RB = 17.033 RF = 10.326 RF^2 = 24.604 ...
0 Lattice parameters (Angstrom or degree) and unit- ...
a b c alpha beta ...
5.39577 5.39577 5.39577 90.0000 90.0000...
0.00005 - - - -...
a = 5.39577(5) a = 5.41165
0.999873 5.411655.39577
= 1.002816
ceria.ins
(1) ceria.ins
(2)21
XLMDX = 0.999873:
14
-
XLMDX = 1.002816:
(3) 173
FWHM1 2.0E-3 1.7E-4 2.1E-3 0.0 0000
FWHM1 2.0E-3 1.7E-4 2.1E-3 0.0 1110
(4) 177
ETA1 0.43 0.36 0.43 0.36 0022
ETA1 0.43 0.36 0.43 0.36 1122
(5) 190
CELLQ1 5.39577 5.39577 5.39577 90.0 90.0 90.0 0.0 ...
CELLQ1 5.41165 5.41165 5.41165 90.0 90.0 90.0 0.0 ...
(6) [Ctrl]+[S] ceria.ins
(7) ceria.bat
(8) RIETAN-FP ceria.lst
(9) Reliability factors, ...
Reliability factors, goodness-of-fit indicator, ...
Rwp = 3.911 Rp = 3.072 RR = 60.502 ...
Ceria
15
-
RB = 17.033 RF = 10.326 RF^2 = 24.604 ...
0 Lattice parameters (Angstrom or degree) and unit- ...
a b c alpha beta ...
5.41165 5.41165 5.41165 90.0000 90.0000...
0.00005 - - - -...
a = 5.41165(5) 1.002816
-
quartz_KCl.ins
(1) quartz_KCl.ins
(2)9
50%Quartz 50%KCl
(3) NBEAM = 2: 12 = 2
(4) NMODE = 0: 15
(5) NPRINT = 0: 18
(6) XLMDX = 1.002816: 21
(7) PCOR2 = 0.05: 22 (8) CTHM2 = 1.0: 25
(9) XMUR2 = 0.0: R 26
(10)30
16
-
'O' 'Si' 'Cl' 'K' /
(11) ff3639
PDF
0.020 0.013
0.133 0.141
0.224 0.311
0.282 0.482
(12) PHNAME1 = Quartz: 45
(13) VNS1 = A-152-1: 47
(14) HKLM1 = P 31 2 1 : 50 (15) LPAIR1 = 1: 54
(16) INDIV1 = 1: 61
(17) PHNAME2 = Potassium Chloride: 90
(18) VNS2 = A-225-1: 92
(19) HKLM2 = F m -3 m : 95
(20) LPAIR2 = 0: 98
(21) NSHIFT = 4: 11 23140
(1) 182
SHIFTN 0.01 0.0 0.0 0.0 1000
0.01
(2) 185
ROUGH 0.0 0.0 0.0 0.0 0000
17
-
(3) 188190
BKGD 2300.8 -885.5 539.6 -452.9 412.1 -191.3
-359.1 45.5 53.6 -15.8 -56.9 13.9
111111111111
11
(1) 207
SCALE1 1.9E-3 1
(2) 209
FWHM1 6.2E-3 2.8E-3 2.6E-3 0.0 1110
(3) 211
ASYM1 1.0 0.0 0.0 0.0 0000
(4) 177
ETA1 0.40 0.12 0.40 0.12 1122
(5) 16 217218
DUMMY1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0
0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0
0000000000000000
(6) f1, r1, f2, r2, f3, r3220
PREF1 1.0 1.0 0.0 1.0 0.0 1.0 000000
(7) a, b, c, , , 226
CELLQ1 4.9124 4.9124 5.4039 90.0 90.0 120.0 0.0 1010000
(8) x, y, z 228229
Si11/Si 1.0 0.5296 0.0 0.333333 0.5 00001
O12/O 1.0 0.4136 0.1460 0.11903 0.7 00001
18
-
(1) 235
SCALE2 4.7E-4 1
(2) 237
FWHM2 6.2E-3 2.8E-3 2.6E-3 0.0 2220
(3) 239
ASYM2 1.0 0.0 0.0 0.0 2220
(4) 241
ETA2 0.40 0.12 0.40 0.12 2222
(5) 16 245246
DUMMY2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0
0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0
0000000000000000
(6) f1, r1, f2, r2, f3, r3248
PREF2 1.0 1.0 0.0 1.0 0.0 1.0 000000
(7) a, b, c, , , 254
CELLQ2 6.292 6.292 6.292 90.0 90.0 90.0 0.0 1000000
(8) x, y, z
255256
K21/K 1.0 0.0 0.0 0.0 0.5 00001
Cl22/Cl 1.0 0.5 0.5 0.5 0.7 00001
(1) 270275
#
19
-
A(ETA1,3)=A(ETA1,1) ; A(ETA1,4)=A(ETA1,2)
A(FWHM2,1)=A(FWHM1,1) ; A(FWHM2,2)=A(FWHM1,2) ;
A(FWHM2,3)=A(FWHM1,3)
A(ASYM2,1)=A(ASYM1,1) ; A(ASYM2,2)=A(ASYM1,2) ;
A(ASYM2,3)=A(ASYM1,3)
A(ETA2,1)=A(ETA1,1) ; A(ETA2,2)=A(ETA1,2)
A(ETA2,3)=A(ETA2,1) ; A(ETA2,4)=A(ETA2,2)
(2) 351
NEXC = 1: .
354357
2 {
0.0 10.0
75.0 180.0
} 2
1075
(3) 352
NINT = 1
(4) 434435
IOFFSET1 = -40000: 1.
IOFFSET2 = -80000: 2.
(5) 445
PC = 50.0
20
-
(5) 487
NLESQ = 2
(1) 655
NPHASE@ = 2:
(2) 661
INTSTAND = 0:
(3) 670672
#
# 'O' 'Si' 'Cl' 'K'/
2.714 17.050 29.795 41.841
PDF
(4) NPHASE@674676
# NPHASE@ m.
# '/' .
3.4 7.6
5.0
21
-
(5) [Ctrl]+[S] quartz_KCl.ins
(1) quartz_KCl.bat
(2) RwP
(3) quartz_KCl.lst
(1) quartz_KCl.ins
(2) 487
NLESQ = 2
NLESQ = 0
(3) [Ctrl]+[S] quartz_KCl.ins
(4) quartz_KCl.bat
(5) quartz_KCl.lst
0 *** Quantitative analysis of the multiphase sample ***
22
-
Mass attenuation coefficients of the elements
O 2.714 cm**2/g
Si 17.050 cm**2/g
Cl 29.795 cm**2/g
K 41.841 cm**2/g
Mean linear attenuation coefficient of the solid ...
Cycle 0 mu(mean) = 50.692 cm**(-1)
Cycle 1 mu(mean) = 51.093 cm**(-1) RDIF...
Cycle 2 mu(mean) = 51.090 cm**(-1) RDIF...
Effective radii (R), ...
Phase ... w X w(cor) X(cor)
Quartz ... 0.5222 0.5755 0.5136 0.5671
Potassium Chloride ... 0.4778 0.4245 0.4864 0.4329
w X w(cor) X(cor) Taylor-Matulis
23
