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CORRECTIONS TO MOLECULAR ONE-ELECTRON PROPERTIES USING MOLLER-PLESSET PERTURBATION-THEORY
被引:43
作者
:
AMOS, RD
论文数:
0
引用数:
0
h-index:
0
AMOS, RD
机构
:
来源
:
CHEMICAL PHYSICS LETTERS
|
1980年
/ 73卷
/ 03期
关键词
:
D O I
:
10.1016/0009-2614(80)80727-5
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:602 / 606
页数:5
相关论文
共 29 条
[1]
MANY-BODY PERTURBATION-THEORY APPLIED TO ELECTRON PAIR CORRELATION ENERGIES .1. CLOSED-SHELL FIRST-ROW DIATOMIC HYDRIDES
BARTLETT, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
JOHNS HOPKINS UNIV,DEPT CHEM,BALTIMORE,MD 21218
BARTLETT, RJ
SILVER, DM
论文数:
0
引用数:
0
h-index:
0
机构:
JOHNS HOPKINS UNIV,DEPT CHEM,BALTIMORE,MD 21218
SILVER, DM
[J].
JOURNAL OF CHEMICAL PHYSICS,
1975,
62
(08)
: 3258
-
3268
[2]
MANY-BODY PERTURBATION-THEORY, COUPLED-PAIR MANY-ELECTRON THEORY, AND IMPORTANCE OF QUADRUPLE EXCITATIONS FOR CORRELATION PROBLEM
BARTLETT, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
Battelle Columbus Laboratories, Columbus, Ohio
BARTLETT, RJ
PURVIS, GD
论文数:
0
引用数:
0
h-index:
0
机构:
Battelle Columbus Laboratories, Columbus, Ohio
PURVIS, GD
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1978,
14
(05)
: 561
-
581
[3]
MOLECULAR APPLICATIONS OF COUPLED CLUSTER AND MANY-BODY PERTURBATION-METHODS
BARTLETT, RJ
论文数:
0
引用数:
0
h-index:
0
BARTLETT, RJ
PURVIS, GD
论文数:
0
引用数:
0
h-index:
0
PURVIS, GD
[J].
PHYSICA SCRIPTA,
1980,
21
(3-4)
: 255
-
265
[4]
MOLLER-PLESSET THEORY FOR ATOMIC GROUND-STATE ENERGIES
BINKLEY, JS
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
BINKLEY, JS
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].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1975,
9
(02)
: 229
-
236
[5]
GRAPHICAL UNITARY GROUP-APPROACH TO THE ELECTRON CORRELATION PROBLEM - METHODS AND PRELIMINARY APPLICATIONS
BROOKS, BR
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, University of California, Berkeley
BROOKS, BR
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, University of California, Berkeley
SCHAEFER, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
70
(11)
: 5092
-
5106
[6]
ELECTRIC DIPOLE POLARIZABILITY OF ATOMS BY HARTREE-FOCK METHOD .I. THEORY FOR CLOSED-SHELL SYSTEMS
COHEN, HD
论文数:
0
引用数:
0
h-index:
0
COHEN, HD
ROOTHAAN, CC
论文数:
0
引用数:
0
h-index:
0
ROOTHAAN, CC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
43
(10)
: S034
-
+
[7]
THE INCLUSION OF HIGH-ORDER REPLACEMENTS IN CONFIGURATION-INTERACTION CALCULATIONS - APPLICATION TO H3O+ INVERSION BARRIER
FERGUSON, WI
论文数:
0
引用数:
0
h-index:
0
FERGUSON, WI
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
HANDY, NC
[J].
CHEMICAL PHYSICS LETTERS,
1980,
71
(01)
: 95
-
100
[8]
DERIVATION OF THE BRUECKNER MANY-BODY THEORY
GOLDSTONE, J
论文数:
0
引用数:
0
h-index:
0
GOLDSTONE, J
[J].
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES,
1957,
239
(1217):
: 267
-
279
[9]
ELECTRIC DIPOLE MOMENT OF DIATOMIC MOLECULES BY CONFIGURATION INTERACTION .1. CLOSED-SHELL MOLECULES
GREEN, S
论文数:
0
引用数:
0
h-index:
0
GREEN, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1971,
54
(03)
: 827
-
&
[10]
GENERALIZATION OF THE DIRECT CONFIGURATION INTERACTION METHOD TO THE HARTREE-FOCK INTERACTING SPACE FOR DOUBLETS, QUARTETS, AND OPEN-SHELL SINGLETS - APPLICATIONS TO NO2 AND NO2-
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
HANDY, NC
GODDARD, JD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
GODDARD, JD
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
SCHAEFER, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
71
(01)
: 426
-
435
←
1
2
3
→
共 29 条
[1]
MANY-BODY PERTURBATION-THEORY APPLIED TO ELECTRON PAIR CORRELATION ENERGIES .1. CLOSED-SHELL FIRST-ROW DIATOMIC HYDRIDES
BARTLETT, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
JOHNS HOPKINS UNIV,DEPT CHEM,BALTIMORE,MD 21218
BARTLETT, RJ
SILVER, DM
论文数:
0
引用数:
0
h-index:
0
机构:
JOHNS HOPKINS UNIV,DEPT CHEM,BALTIMORE,MD 21218
SILVER, DM
[J].
JOURNAL OF CHEMICAL PHYSICS,
1975,
62
(08)
: 3258
-
3268
[2]
MANY-BODY PERTURBATION-THEORY, COUPLED-PAIR MANY-ELECTRON THEORY, AND IMPORTANCE OF QUADRUPLE EXCITATIONS FOR CORRELATION PROBLEM
BARTLETT, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
Battelle Columbus Laboratories, Columbus, Ohio
BARTLETT, RJ
PURVIS, GD
论文数:
0
引用数:
0
h-index:
0
机构:
Battelle Columbus Laboratories, Columbus, Ohio
PURVIS, GD
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1978,
14
(05)
: 561
-
581
[3]
MOLECULAR APPLICATIONS OF COUPLED CLUSTER AND MANY-BODY PERTURBATION-METHODS
BARTLETT, RJ
论文数:
0
引用数:
0
h-index:
0
BARTLETT, RJ
PURVIS, GD
论文数:
0
引用数:
0
h-index:
0
PURVIS, GD
[J].
PHYSICA SCRIPTA,
1980,
21
(3-4)
: 255
-
265
[4]
MOLLER-PLESSET THEORY FOR ATOMIC GROUND-STATE ENERGIES
BINKLEY, JS
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
BINKLEY, JS
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].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1975,
9
(02)
: 229
-
236
[5]
GRAPHICAL UNITARY GROUP-APPROACH TO THE ELECTRON CORRELATION PROBLEM - METHODS AND PRELIMINARY APPLICATIONS
BROOKS, BR
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, University of California, Berkeley
BROOKS, BR
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, University of California, Berkeley
SCHAEFER, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
70
(11)
: 5092
-
5106
[6]
ELECTRIC DIPOLE POLARIZABILITY OF ATOMS BY HARTREE-FOCK METHOD .I. THEORY FOR CLOSED-SHELL SYSTEMS
COHEN, HD
论文数:
0
引用数:
0
h-index:
0
COHEN, HD
ROOTHAAN, CC
论文数:
0
引用数:
0
h-index:
0
ROOTHAAN, CC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
43
(10)
: S034
-
+
[7]
THE INCLUSION OF HIGH-ORDER REPLACEMENTS IN CONFIGURATION-INTERACTION CALCULATIONS - APPLICATION TO H3O+ INVERSION BARRIER
FERGUSON, WI
论文数:
0
引用数:
0
h-index:
0
FERGUSON, WI
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
HANDY, NC
[J].
CHEMICAL PHYSICS LETTERS,
1980,
71
(01)
: 95
-
100
[8]
DERIVATION OF THE BRUECKNER MANY-BODY THEORY
GOLDSTONE, J
论文数:
0
引用数:
0
h-index:
0
GOLDSTONE, J
[J].
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES,
1957,
239
(1217):
: 267
-
279
[9]
ELECTRIC DIPOLE MOMENT OF DIATOMIC MOLECULES BY CONFIGURATION INTERACTION .1. CLOSED-SHELL MOLECULES
GREEN, S
论文数:
0
引用数:
0
h-index:
0
GREEN, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1971,
54
(03)
: 827
-
&
[10]
GENERALIZATION OF THE DIRECT CONFIGURATION INTERACTION METHOD TO THE HARTREE-FOCK INTERACTING SPACE FOR DOUBLETS, QUARTETS, AND OPEN-SHELL SINGLETS - APPLICATIONS TO NO2 AND NO2-
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
HANDY, NC
GODDARD, JD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
GODDARD, JD
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720
SCHAEFER, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
71
(01)
: 426
-
435
←
1
2
3
→