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GROUND-STATES OF MOLECULES .39. MNDO RESULTS FOR MOLECULES CONTAINING HYDROGEN, CARBON, NITROGEN, AND OXYGEN
被引:2290
作者
:
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
DEWAR, MJS
[
1
]
THIEL, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
THIEL, W
[
1
]
机构
:
[1]
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
来源
:
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
|
1977年
/ 99卷
/ 15期
关键词
:
D O I
:
10.1021/ja00457a005
中图分类号
:
O6 [化学];
学科分类号
:
0703 ;
摘要
:
引用
收藏
页码:4907 / 4917
页数:11
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共 18 条
[1]
GROUND-STATES OF MOLECULES .26. MINDO-3 CALCULATIONS FOR HYDROCARBONS
BINGHAM, RC
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h-index:
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机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
BINGHAM, RC
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
DEWAR, MJS
LO, DH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
LO, DH
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1975,
97
(06)
: 1294
-
1301
[2]
BINGHAM RC, 1975, J AM CHEM SOC, V97, P1298
[3]
PERFLUORO EFFECT IN PHOTOELECTRON SPECTROSCOPY .2. AROMATIC MOLECULES
BRUNDLE, CR
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0
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0
BRUNDLE, CR
KEUBLER, NA
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0
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0
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KEUBLER, NA
ROBIN, MB
论文数:
0
引用数:
0
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ROBIN, MB
[J].
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94
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: 1466
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[4]
Ab initio SCF calculations for azulene and naphthalene
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Department of Chemistry, University of Nebraska, Lincoln
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Department of Chemistry, University of Nebraska, Lincoln
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[J].
CHEMICAL PHYSICS LETTERS,
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3
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[5]
ELECTRONIC STRUCTURE OF DIATOMIC MOLECULES .3. A HARTREE-FOCK WAVEFUNCTIONS AND ENERGY QUANTITIES FOR N2(X1SIGMAG+) AND N2+(X2SIGMAG+A 2PIU B2SIGMAU+) MOLECULAR IONS
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0
WAHL, AC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(05)
: 1973
-
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[6]
CEDARBAUM L, 1974, CHEM PHYS LETT, V25, P562
[7]
MOLECULAR-ORBITAL THEORY OF ELECTRONIC-STRUCTURE OF ORGANIC COMPOUNDS .23. PSEUDOROTATION IN SATURATED 5-MEMBERED RING COMPOUNDS
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CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
POPLE, JA
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1975,
97
(06)
: 1358
-
1367
[8]
VARIANCE ALGORITHM FOR MINIMIZATION
DAVIDON, WC
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[J].
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10
(04)
: 406
-
&
[9]
GROUND-STATES OF MOLECULES .38. MNDO METHOD - APPROXIMATIONS AND PARAMETERS
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
DEWAR, MJS
THIEL, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
THIEL, W
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1977,
99
(15)
: 4899
-
4907
[10]
GROUND STATES OF CONJUGATED MOLECULES .9. HYDROCARBON RADICALS AND RADICAL IONS
DEWAR, MJS
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h-index:
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[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
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90
(08)
: 1953
-
&
←
1
2
→
共 18 条
[1]
GROUND-STATES OF MOLECULES .26. MINDO-3 CALCULATIONS FOR HYDROCARBONS
BINGHAM, RC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
BINGHAM, RC
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
DEWAR, MJS
LO, DH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
LO, DH
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1975,
97
(06)
: 1294
-
1301
[2]
BINGHAM RC, 1975, J AM CHEM SOC, V97, P1298
[3]
PERFLUORO EFFECT IN PHOTOELECTRON SPECTROSCOPY .2. AROMATIC MOLECULES
BRUNDLE, CR
论文数:
0
引用数:
0
h-index:
0
BRUNDLE, CR
KEUBLER, NA
论文数:
0
引用数:
0
h-index:
0
KEUBLER, NA
ROBIN, MB
论文数:
0
引用数:
0
h-index:
0
ROBIN, MB
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1972,
94
(05)
: 1466
-
&
[4]
Ab initio SCF calculations for azulene and naphthalene
Buenker, R. J.
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, University of Nebraska, Lincoln
Buenker, R. J.
Peyerimhoff, S. D.
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, University of Nebraska, Lincoln
Peyerimhoff, S. D.
[J].
CHEMICAL PHYSICS LETTERS,
1969,
3
(01)
: 37
-
42
[5]
ELECTRONIC STRUCTURE OF DIATOMIC MOLECULES .3. A HARTREE-FOCK WAVEFUNCTIONS AND ENERGY QUANTITIES FOR N2(X1SIGMAG+) AND N2+(X2SIGMAG+A 2PIU B2SIGMAU+) MOLECULAR IONS
CADE, PE
论文数:
0
引用数:
0
h-index:
0
CADE, PE
SALES, KD
论文数:
0
引用数:
0
h-index:
0
SALES, KD
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
WAHL, AC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(05)
: 1973
-
&
[6]
CEDARBAUM L, 1974, CHEM PHYS LETT, V25, P562
[7]
MOLECULAR-ORBITAL THEORY OF ELECTRONIC-STRUCTURE OF ORGANIC COMPOUNDS .23. PSEUDOROTATION IN SATURATED 5-MEMBERED RING COMPOUNDS
CREMER, D
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
CREMER, D
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213
POPLE, JA
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1975,
97
(06)
: 1358
-
1367
[8]
VARIANCE ALGORITHM FOR MINIMIZATION
DAVIDON, WC
论文数:
0
引用数:
0
h-index:
0
DAVIDON, WC
[J].
COMPUTER JOURNAL,
1968,
10
(04)
: 406
-
&
[9]
GROUND-STATES OF MOLECULES .38. MNDO METHOD - APPROXIMATIONS AND PARAMETERS
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
DEWAR, MJS
THIEL, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,DEPT CHEM,AUSTIN,TX 78712
THIEL, W
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1977,
99
(15)
: 4899
-
4907
[10]
GROUND STATES OF CONJUGATED MOLECULES .9. HYDROCARBON RADICALS AND RADICAL IONS
DEWAR, MJS
论文数:
0
引用数:
0
h-index:
0
DEWAR, MJS
HASHMALL, JA
论文数:
0
引用数:
0
h-index:
0
HASHMALL, JA
VENIER, CG
论文数:
0
引用数:
0
h-index:
0
VENIER, CG
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1968,
90
(08)
: 1953
-
&
←
1
2
→