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7/26/2019 Makalah Kim Komputasi 123
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MAKALAH
KIMIA KOMPUTASI
KONSEP DASAR KIMIA KOMPUTASI DAN PEMODELAN MOLEKUL
DISUSUN OLEH :
KELOMPOK I
1.JUNIARDO SINAGA (F1C114048)
2.SUSI HARDIYANI (F1C114002)
3.SILIA DEI EKA PUTRI(F1C114004)
4.SILIA !AHYUNI (F1C114008)
".NUR KHOMARIAH (F1C11401#)
#.LI$A SRI MARNINGSIH (F1C114024)
%.NEIRA TRIA YESICHA (F1C114034)
8.PUTRI PERMATA SARI (F1C1140"4)
DOSEN PENGAMPU : DIAH MASTUTIK&S.P'.&M.S
PROGRAM STUDI KIMIA
FAKULTAS SAINS DAN TEKNOLOGI
UNIERSITAS JAMI
201#
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DAFTAR ISI
DAFTAR ISI.............................................................................................................
KATA PENGANTAR..............................................................................................
A IPENDAHULUAN........................................................................................1
1.1 L*+*, -*/*...............................................................................................1
1.2 R* M***5..........................................................................................2
1.3 T6*............................................................................................................2
1.4 M*7**+..........................................................................................................2
A IIPEMAHASAN.........................................................................................3
2.1 P--,+* K* K9+*.........................................................................32.2 K-9 D**, K* K9+*....................................................................4
2.3 M-+'- K9+*.......................................................................................1#
2.4 P-'-* M-/.....................................................................................18
A IIIPENUTUP...............................................................................................22
3.1 K-9*..................................................................................................22
3.2 S*,*.............................................................................................................22
DAFTAR PUSTAKA.............................................................................................23
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KATA PENGANTAR
P6 /, /* 9*6*+/* /-5*',*+ T5* Y* M*5* E* /*,-*
'-* ,*5*+& /*,*& -,+* +*7/ '* 5'**5;N* /* '*9*+ ---*/*
*/**5 +-+* P-*7**+*
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BAB I
PENDAHULUAN
1.1 Latar Belakang
S-6*/ '*5 /* +-,/-* -
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6* -,**/* 7*+;7*+ '*, -/.K*,-* +& /* /9+*
**+*5 9-+&+-,+**
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BAB II
PEMBAHASAN
2.1 Pengert'an K''a K()uta!'
K* /9+* *'**5 >*
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+-//;+-//* -5 /*=* '** 9-,>5,'-, *'**5 9-,*** '7-,-* 9*,* '-*
*'**5 7 -*,* 9*+
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'**&
2. A9,/* MO LCAO
O,
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E-, ,*,* +/ --/* 9-'-/*+*
/---+*+- --, +-,-'*5 *+* /-*'** '**,. I'- '**, '*, -+'- *'**5
5*,*-/9-/+* '*, 9-,*+, --, H * '-
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K*,-* --, +-,-'*5 -
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D* /*,-* / *'**5 7 -- */* 9*'**
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--/+, *'**5 7 9 --/+, ,& '* 7
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S-
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-5*/* [0& -
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D* *'**5 +/*+ --, H2W/,*;/,*. uadan ub
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5*, '*/*.
Gaar 3.#E-, 9+-* H2W.
P-,*** -5*/* CA C& '* '-* -*/* /'
,** /+* -'*9*+/* *: K-'* /+*
-*/* ub,9 '-* ' *+*& '* -5*/*:
K& 9-,5*+/* */* 7/ 7;7
-
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-
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+-,* '** 9-,*** '**,& '* '*9*+ '*
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* -5*/* 9-,*** +*. D
&Hpq'*+*/* '-* 9-,*** *9** /-+-+* * +
'*, -+'- *< + & '9-,/* =*/+ 9-,* * ** -5* 5**
/ '+-,*9/* 9*'* -/;-/ /->. M-+'- 9-,5+* -/*/*
/*+ *< + -,9*/* **5 *+ -+'- 9-,5+* /* -* -+'-
-/*/* /*+ - -9, *+* 9 -+'- -/*/* -/-,.
K-* '*, -+'- *< + *'**5 * '/-
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'* +-,* --/+,& * ''-/*+ *+* ** -/* '5*/*. D** ,*/*
+/ -,-/ /-**5* '9-,/-*/* '-* -5*/*
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a M-+'- -/*/* /*+& -+'- -*/* '**, 5/;5/
7/* /*+ -* 9-,5+* '+-+*9/* '-* +,/+, * **
-
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9-,/,** *+-*+/*& -9-,+ -*/* +* T5-,)
U+/ -'*9*+/* 5* 9-,5+* /9+* '-* */,* + */*
9*'* * 9-'-/*+* * '*/* (-+'- *< +) *'**5 +-,
+,/+, --/+,. T-+*9& 9-'-/*+* -/ /-/,**& *+ =*/+
9-,5+* /9+** ** '/9 '-*
-*/* -/*/* 7/* /*/ '-* -*/* -
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'* /*/*+, +**. K 9-'-* -/ +-,/*+ -,*+ '-* 9-'-*
/9+-,& /*,-* /9+* +-*5 -- 9-'-* -/ -6*' -*,* +-,+ '-*
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9-,-*/ '* 9-*,+ * -7-/+7 '* -7- +/ -+- -*=* * /+*
.
C+5:
U+/ +- A P-,/5,*+ (AP)
(NH4CIO4)
K-/* 9-,-*/ * /:
a N*CIO4'-* NH4C1
a N*CICO4'-* NH4NO3
a N*CO4 '-* NH4SO4
M*/* '-*
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a P-'-/*+* /9+* +/ -,*>* -/ * *,*;
>*,* * /5& /5* '** 9-,*>** 5.2001).
22
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BAB III
PENUTUP
#.1 Ke!')ulan
-,'**,/* 9-
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DAFTAR PUSTAKA
F,-*& J. .& F,>5& JE.& 13.Exploring Chei!tr" #ith Ele$troni% Stru%ture
ðod' 2'-'+. G**& I>.& P++5& A'-= R.& 2001.&ole%ular &odelling ( )rin%iple! and *ppli%ation!. 2'
-'+. P-*, E'*>*+ L+-'.
M*,+9,*=& M5**' A.& G,*+ d R>5*,'& 18. +iia +oputa!i.
P--,