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A MULTI-REFERENCE APPROACH TO ENERGY DECOMPOSITION FOR MOLECULAR-INTERACTIONS
被引:26
作者
:
BERNARDI, F
论文数:
0
引用数:
0
h-index:
0
机构:
IST CHIM ORGAN,BOLOGNA,ITALY
IST CHIM ORGAN,BOLOGNA,ITALY
BERNARDI, F
[
1
]
ROBB, MA
论文数:
0
引用数:
0
h-index:
0
机构:
IST CHIM ORGAN,BOLOGNA,ITALY
IST CHIM ORGAN,BOLOGNA,ITALY
ROBB, MA
[
1
]
机构
:
[1]
IST CHIM ORGAN,BOLOGNA,ITALY
来源
:
MOLECULAR PHYSICS
|
1983年
/ 48卷
/ 06期
关键词
:
D O I
:
10.1080/00268978300100961
中图分类号
:
O64 [物理化学(理论化学)、化学物理学];
学科分类号
:
070304 ;
081704 ;
摘要
:
引用
收藏
页码:1345 / 1355
页数:11
相关论文
共 26 条
[21]
GROUND ELECTRONIC STATE OF SILAETHYLENE - AB-INITIO MOLECULAR-ORBITAL STUDY OF LOWER ELECTRONIC MANIFOLD
STRAUSZ, OP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
STRAUSZ, OP
GAMMIE, L
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
GAMMIE, L
THEODORAKOUPOULOS, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
THEODORAKOUPOULOS, G
MEZEY, PG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
MEZEY, PG
CSIZMADIA, IG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
CSIZMADIA, IG
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1976,
98
(06)
: 1622
-
1624
[22]
MOLECULAR-ORBITALS FROM GROUP ORBITALS .3. QUANTITATIVE PERTURBATIONAL MOLECULAR-ORBITAL ANALYSIS OF ABINITIO SCF-MO WAVE-FUNCTIONS
WHANGBO, MH
论文数:
0
引用数:
0
h-index:
0
机构:
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
WHANGBO, MH
SCHLEGEL, HB
论文数:
0
引用数:
0
h-index:
0
机构:
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
SCHLEGEL, HB
WOLFE, S
论文数:
0
引用数:
0
h-index:
0
机构:
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
WOLFE, S
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1977,
99
(05)
: 1296
-
1304
[23]
WHITESIDE RA, 1980, CARNEGIE MELLON QUAN
[24]
MOLECULAR-ORBITALS FROM GROUP ORBITALS .5. ROLE OF STERIC EFFECTS IN PERTURBATIONAL MOLECULAR-ORBITAL METHOD OF CONFORMATIONAL-ANALYSIS
WOLFE, S
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
WOLFE, S
MITCHELL, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
MITCHELL, DJ
WHANGBO, MH
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
WHANGBO, MH
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1978,
100
(06)
: 1936
-
1938
[25]
WOLFE S, 1978, J AM CHEM SOC, V100, P3696
[26]
ABINITIO CALCULATION OF REACTION PATH FOR ADDITION OF SINGLET (1A1) METHYLENE TO ETHYLENE
ZURAWSKI, B
论文数:
0
引用数:
0
h-index:
0
机构:
RUHR UNIV BOCHUM,LEHRSTUHL THEORET CHEM,D-4630 BOCHUM,FED REP GER
ZURAWSKI, B
KUTZELNIGG, W
论文数:
0
引用数:
0
h-index:
0
机构:
RUHR UNIV BOCHUM,LEHRSTUHL THEORET CHEM,D-4630 BOCHUM,FED REP GER
KUTZELNIGG, W
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1978,
100
(09)
: 2654
-
2659
←
1
2
3
→
共 26 条
[21]
GROUND ELECTRONIC STATE OF SILAETHYLENE - AB-INITIO MOLECULAR-ORBITAL STUDY OF LOWER ELECTRONIC MANIFOLD
STRAUSZ, OP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
STRAUSZ, OP
GAMMIE, L
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
GAMMIE, L
THEODORAKOUPOULOS, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
THEODORAKOUPOULOS, G
MEZEY, PG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
MEZEY, PG
CSIZMADIA, IG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
CSIZMADIA, IG
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1976,
98
(06)
: 1622
-
1624
[22]
MOLECULAR-ORBITALS FROM GROUP ORBITALS .3. QUANTITATIVE PERTURBATIONAL MOLECULAR-ORBITAL ANALYSIS OF ABINITIO SCF-MO WAVE-FUNCTIONS
WHANGBO, MH
论文数:
0
引用数:
0
h-index:
0
机构:
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
WHANGBO, MH
SCHLEGEL, HB
论文数:
0
引用数:
0
h-index:
0
机构:
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
SCHLEGEL, HB
WOLFE, S
论文数:
0
引用数:
0
h-index:
0
机构:
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
QUEENS UNIV,DEPT CHEM,KINGSTON K7L 3N6,ONTARIO,CANADA
WOLFE, S
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1977,
99
(05)
: 1296
-
1304
[23]
WHITESIDE RA, 1980, CARNEGIE MELLON QUAN
[24]
MOLECULAR-ORBITALS FROM GROUP ORBITALS .5. ROLE OF STERIC EFFECTS IN PERTURBATIONAL MOLECULAR-ORBITAL METHOD OF CONFORMATIONAL-ANALYSIS
WOLFE, S
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
WOLFE, S
MITCHELL, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
MITCHELL, DJ
WHANGBO, MH
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853
WHANGBO, MH
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1978,
100
(06)
: 1936
-
1938
[25]
WOLFE S, 1978, J AM CHEM SOC, V100, P3696
[26]
ABINITIO CALCULATION OF REACTION PATH FOR ADDITION OF SINGLET (1A1) METHYLENE TO ETHYLENE
ZURAWSKI, B
论文数:
0
引用数:
0
h-index:
0
机构:
RUHR UNIV BOCHUM,LEHRSTUHL THEORET CHEM,D-4630 BOCHUM,FED REP GER
ZURAWSKI, B
KUTZELNIGG, W
论文数:
0
引用数:
0
h-index:
0
机构:
RUHR UNIV BOCHUM,LEHRSTUHL THEORET CHEM,D-4630 BOCHUM,FED REP GER
KUTZELNIGG, W
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1978,
100
(09)
: 2654
-
2659
←
1
2
3
→