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SLOW CONVERGENCE OF THE MOLLER-PLESSET PERTURBATION-SERIES - THE DISSOCIATION-ENERGY OF HYDROGEN-CYANIDE AND THE ELECTRON-AFFINITY OF THE CYANO RADICAL
被引:147
作者
:
NOBES, RH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
NOBES, RH
[
1
]
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
POPLE, JA
[
1
]
RADOM, L
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
RADOM, L
[
1
]
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
HANDY, NC
[
1
]
KNOWLES, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
KNOWLES, PJ
[
1
]
机构
:
[1]
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
来源
:
CHEMICAL PHYSICS LETTERS
|
1987年
/ 138卷
/ 05期
关键词
:
D O I
:
10.1016/0009-2614(87)80545-6
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:481 / 485
页数:5
相关论文
共 21 条
[11]
THE CALCULATION OF HIGHER-ORDER ENERGIES IN THE MANY-BODY PERTURBATION-THEORY SERIES
KNOWLES, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
KNOWLES, PJ
SOMASUNDRAM, K
论文数:
0
引用数:
0
h-index:
0
机构:
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
SOMASUNDRAM, K
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
机构:
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
HANDY, NC
HIRAO, K
论文数:
0
引用数:
0
h-index:
0
机构:
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
HIRAO, K
[J].
CHEMICAL PHYSICS LETTERS,
1985,
113
(01)
: 8
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12
[12]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .20. BASIS SET FOR CORRELATED WAVE-FUNCTIONS
KRISHNAN, R
论文数:
0
引用数:
0
h-index:
0
KRISHNAN, R
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
BINKLEY, JS
SEEGER, R
论文数:
0
引用数:
0
h-index:
0
SEEGER, R
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1980,
72
(01)
: 650
-
654
[13]
CONTRIBUTION OF TRIPLE SUBSTITUTIONS TO THE ELECTRON CORRELATION-ENERGY IN 4TH ORDER PERTURBATION-THEORY
KRISHNAN, R
论文数:
0
引用数:
0
h-index:
0
KRISHNAN, R
FRISCH, MJ
论文数:
0
引用数:
0
h-index:
0
FRISCH, MJ
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1980,
72
(07)
: 4244
-
4245
[14]
CLASSIFICATION OF CONFIGURATIONS AND DETERMINATION OF INTERACTING AND NONINTERACTING SPACES IN CONFIGURATION INTERACTION
MCLEAN, AD
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95114
IBM CORP,RES LAB,SAN JOSE,CA 95114
MCLEAN, AD
LIU, B
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95114
IBM CORP,RES LAB,SAN JOSE,CA 95114
LIU, B
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(03)
: 1066
-
1078
[15]
Note on an approximation treatment for many-electron systems
Moller, C
论文数:
0
引用数:
0
h-index:
0
Moller, C
Plesset, MS
论文数:
0
引用数:
0
h-index:
0
Plesset, MS
[J].
PHYSICAL REVIEW,
1934,
46
(07):
: 0618
-
0622
[16]
ELECTRON-AFFINITY CALCULATIONS ON NH-2-, PH-2-, CN-, SH-, OH-, CL-, AND F- - BASIS-SETS AND DIRECT VS INDIRECT METHODS
ORTIZ, JV
论文数:
0
引用数:
0
h-index:
0
ORTIZ, JV
[J].
JOURNAL OF CHEMICAL PHYSICS,
1987,
86
(01)
: 308
-
312
[17]
ELECTRON CORRELATION THEORIES AND THEIR APPLICATION TO STUDY OF SIMPLE REACTION POTENTIAL SURFACES
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
KRISHNAN, R
论文数:
0
引用数:
0
h-index:
0
KRISHNAN, R
SCHLEGEL, HB
论文数:
0
引用数:
0
h-index:
0
SCHLEGEL, HB
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
BINKLEY, JS
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1978,
14
(05)
: 545
-
560
[18]
POPLE JA, 1976, INT J QUANTUM CHEM, P1
[19]
AN AUGMENTED COUPLED CLUSTER METHOD AND ITS APPLICATION TO THE 1ST-ROW HOMONUCLEAR DIATOMICS
RAGHAVACHARI, K
论文数:
0
引用数:
0
h-index:
0
RAGHAVACHARI, K
[J].
JOURNAL OF CHEMICAL PHYSICS,
1985,
82
(10)
: 4607
-
4610
[20]
THE SELF-CONSISTENT ELECTRON PAIRS METHOD FOR MULTICONFIGURATION REFERENCE STATE FUNCTIONS
WERNER, HJ
论文数:
0
引用数:
0
h-index:
0
WERNER, HJ
REINSCH, EA
论文数:
0
引用数:
0
h-index:
0
REINSCH, EA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1982,
76
(06)
: 3144
-
3156
←
1
2
3
→
共 21 条
[11]
THE CALCULATION OF HIGHER-ORDER ENERGIES IN THE MANY-BODY PERTURBATION-THEORY SERIES
KNOWLES, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
KNOWLES, PJ
SOMASUNDRAM, K
论文数:
0
引用数:
0
h-index:
0
机构:
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
SOMASUNDRAM, K
HANDY, NC
论文数:
0
引用数:
0
h-index:
0
机构:
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
HANDY, NC
HIRAO, K
论文数:
0
引用数:
0
h-index:
0
机构:
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
NAGOYA UNIV, COLL GEN EDUC, DEPT CHEM, NAGOYA, AICHI 464, JAPAN
HIRAO, K
[J].
CHEMICAL PHYSICS LETTERS,
1985,
113
(01)
: 8
-
12
[12]
SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .20. BASIS SET FOR CORRELATED WAVE-FUNCTIONS
KRISHNAN, R
论文数:
0
引用数:
0
h-index:
0
KRISHNAN, R
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
BINKLEY, JS
SEEGER, R
论文数:
0
引用数:
0
h-index:
0
SEEGER, R
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1980,
72
(01)
: 650
-
654
[13]
CONTRIBUTION OF TRIPLE SUBSTITUTIONS TO THE ELECTRON CORRELATION-ENERGY IN 4TH ORDER PERTURBATION-THEORY
KRISHNAN, R
论文数:
0
引用数:
0
h-index:
0
KRISHNAN, R
FRISCH, MJ
论文数:
0
引用数:
0
h-index:
0
FRISCH, MJ
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1980,
72
(07)
: 4244
-
4245
[14]
CLASSIFICATION OF CONFIGURATIONS AND DETERMINATION OF INTERACTING AND NONINTERACTING SPACES IN CONFIGURATION INTERACTION
MCLEAN, AD
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95114
IBM CORP,RES LAB,SAN JOSE,CA 95114
MCLEAN, AD
LIU, B
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP,RES LAB,SAN JOSE,CA 95114
IBM CORP,RES LAB,SAN JOSE,CA 95114
LIU, B
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(03)
: 1066
-
1078
[15]
Note on an approximation treatment for many-electron systems
Moller, C
论文数:
0
引用数:
0
h-index:
0
Moller, C
Plesset, MS
论文数:
0
引用数:
0
h-index:
0
Plesset, MS
[J].
PHYSICAL REVIEW,
1934,
46
(07):
: 0618
-
0622
[16]
ELECTRON-AFFINITY CALCULATIONS ON NH-2-, PH-2-, CN-, SH-, OH-, CL-, AND F- - BASIS-SETS AND DIRECT VS INDIRECT METHODS
ORTIZ, JV
论文数:
0
引用数:
0
h-index:
0
ORTIZ, JV
[J].
JOURNAL OF CHEMICAL PHYSICS,
1987,
86
(01)
: 308
-
312
[17]
ELECTRON CORRELATION THEORIES AND THEIR APPLICATION TO STUDY OF SIMPLE REACTION POTENTIAL SURFACES
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
KRISHNAN, R
论文数:
0
引用数:
0
h-index:
0
KRISHNAN, R
SCHLEGEL, HB
论文数:
0
引用数:
0
h-index:
0
SCHLEGEL, HB
BINKLEY, JS
论文数:
0
引用数:
0
h-index:
0
BINKLEY, JS
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1978,
14
(05)
: 545
-
560
[18]
POPLE JA, 1976, INT J QUANTUM CHEM, P1
[19]
AN AUGMENTED COUPLED CLUSTER METHOD AND ITS APPLICATION TO THE 1ST-ROW HOMONUCLEAR DIATOMICS
RAGHAVACHARI, K
论文数:
0
引用数:
0
h-index:
0
RAGHAVACHARI, K
[J].
JOURNAL OF CHEMICAL PHYSICS,
1985,
82
(10)
: 4607
-
4610
[20]
THE SELF-CONSISTENT ELECTRON PAIRS METHOD FOR MULTICONFIGURATION REFERENCE STATE FUNCTIONS
WERNER, HJ
论文数:
0
引用数:
0
h-index:
0
WERNER, HJ
REINSCH, EA
论文数:
0
引用数:
0
h-index:
0
REINSCH, EA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1982,
76
(06)
: 3144
-
3156
←
1
2
3
→