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ELECTRON CORRELATION AND BASIS SET EFFECTS ON THE RELATIVE STABILITIES OF CLASSICAL AND NON-CLASSICAL STRUCTURES OF THE 2-NORBORNYL CATION
被引:47
作者
:
YOSHIMINE, M
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95193
YOSHIMINE, M
MCLEAN, AD
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95193
MCLEAN, AD
LIU, B
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95193
LIU, B
DEFREES, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95193
DEFREES, DJ
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95193
BINKLEY, JS
机构
:
[1]
IBM CORP,RES LAB,SAN JOSE,CA 95193
[2]
MOLEC RES INST,PALO ALTO,CA 94304
[3]
SANDIA NATL LABS,LIVERMORE,CA 94550
来源
:
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
|
1983年
/ 105卷
/ 19期
关键词
:
D O I
:
10.1021/ja00357a055
中图分类号
:
O6 [化学];
学科分类号
:
0703 ;
摘要
:
引用
收藏
页码:6185 / 6186
页数:2
相关论文
共 10 条
[1]
Brown H. C, 1977, NONCLASSICAL ION PRO
[2]
CHANDLER G, UNPUB
[3]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES
DITCHFIELD, R
论文数:
0
引用数:
0
h-index:
0
DITCHFIELD, R
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1971,
54
(02)
: 724
-
+
[4]
GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .1. CONTRACTION OF (9S5P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS
DUNNING, TH
论文数:
0
引用数:
0
h-index:
0
DUNNING, TH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(07)
: 2823
-
+
[5]
COMPLETE THEORETICAL STRUCTURES FOR THE CLASSICAL AND NON-CLASSICAL FORMS OF THE 2-NORBORNYL CATION AND FOR EDGE-PROTONATED NORTRICYCLENE
GODDARD, JD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
GODDARD, JD
OSAMURA, Y
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
OSAMURA, Y
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
SCHAEFER, HF
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1982,
104
(12)
: 3258
-
3262
[6]
GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I.
HUZINAGA, S
论文数:
0
引用数:
0
h-index:
0
HUZINAGA, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(04)
: 1293
-
&
[7]
KRISHNAN R, COMMUNICATION
[8]
CONFIGURATION INTERACTION CALCULATIONS ON NITROGEN MOLECULE
LANGHOFF, SR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
LANGHOFF, SR
DAVIDSON, ER
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
DAVIDSON, ER
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1974,
8
(01)
: 61
-
72
[9]
THE ALCHEMY CONFIGURATION-INTERACTION METHOD .1. THE SYMBOLIC MATRIX-METHOD FOR DETERMINING ELEMENTS OF MATRIX OPERATORS
LIU, B
论文数:
0
引用数:
0
h-index:
0
LIU, B
YOSHIMINE, M
论文数:
0
引用数:
0
h-index:
0
YOSHIMINE, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1981,
74
(01)
: 612
-
616
[10]
RESOLVED C-13 NMR-SPECTRA OF CARBONIUM-IONS AT CRYOGENIC TEMPERATURES - THE NORBORNYL CATION AT 5 K
YANNONI, CS
论文数:
0
引用数:
0
h-index:
0
机构:
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
YANNONI, CS
MACHO, V
论文数:
0
引用数:
0
h-index:
0
机构:
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
MACHO, V
MYHRE, PC
论文数:
0
引用数:
0
h-index:
0
机构:
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
MYHRE, PC
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1982,
104
(25)
: 7380
-
7381
←
1
→
共 10 条
[1]
Brown H. C, 1977, NONCLASSICAL ION PRO
[2]
CHANDLER G, UNPUB
[3]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES
DITCHFIELD, R
论文数:
0
引用数:
0
h-index:
0
DITCHFIELD, R
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1971,
54
(02)
: 724
-
+
[4]
GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .1. CONTRACTION OF (9S5P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS
DUNNING, TH
论文数:
0
引用数:
0
h-index:
0
DUNNING, TH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(07)
: 2823
-
+
[5]
COMPLETE THEORETICAL STRUCTURES FOR THE CLASSICAL AND NON-CLASSICAL FORMS OF THE 2-NORBORNYL CATION AND FOR EDGE-PROTONATED NORTRICYCLENE
GODDARD, JD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
GODDARD, JD
OSAMURA, Y
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
OSAMURA, Y
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
UNIV TEXAS,INST THEORET CHEM,DEPT CHEM,AUSTIN,TX 78712
SCHAEFER, HF
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1982,
104
(12)
: 3258
-
3262
[6]
GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I.
HUZINAGA, S
论文数:
0
引用数:
0
h-index:
0
HUZINAGA, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(04)
: 1293
-
&
[7]
KRISHNAN R, COMMUNICATION
[8]
CONFIGURATION INTERACTION CALCULATIONS ON NITROGEN MOLECULE
LANGHOFF, SR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
LANGHOFF, SR
DAVIDSON, ER
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
DAVIDSON, ER
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1974,
8
(01)
: 61
-
72
[9]
THE ALCHEMY CONFIGURATION-INTERACTION METHOD .1. THE SYMBOLIC MATRIX-METHOD FOR DETERMINING ELEMENTS OF MATRIX OPERATORS
LIU, B
论文数:
0
引用数:
0
h-index:
0
LIU, B
YOSHIMINE, M
论文数:
0
引用数:
0
h-index:
0
YOSHIMINE, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1981,
74
(01)
: 612
-
616
[10]
RESOLVED C-13 NMR-SPECTRA OF CARBONIUM-IONS AT CRYOGENIC TEMPERATURES - THE NORBORNYL CATION AT 5 K
YANNONI, CS
论文数:
0
引用数:
0
h-index:
0
机构:
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
YANNONI, CS
MACHO, V
论文数:
0
引用数:
0
h-index:
0
机构:
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
MACHO, V
MYHRE, PC
论文数:
0
引用数:
0
h-index:
0
机构:
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
HARVEY MUDD COLL,DEPT CHEM,CLAREMONT,CA 91711
MYHRE, PC
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1982,
104
(25)
: 7380
-
7381
←
1
→