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THE POTENTIAL-ENERGY CURVES OF HEBE, HEMG AND BEMG
被引:30
作者
:
CHILES, RA
论文数:
0
引用数:
0
h-index:
0
CHILES, RA
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
DYKSTRA, CE
机构
:
来源
:
CHEMICAL PHYSICS LETTERS
|
1982年
/ 85卷
/ 04期
关键词
:
D O I
:
10.1016/0009-2614(82)83491-X
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:447 / 450
页数:4
相关论文
共 32 条
[1]
PNO-CI (PAIR NATURAL ORBITAL CONFIGURATION INTERACTION) AND CEPA-PNO (COUPLED ELECTRON PAIR APPROXIMATION WITH PAIR NATURAL ORBITALS) CALCULATIONS OF MOLECULAR SYSTEMS .1. OUTLINE OF METHOD FOR CLOSED-SHELL STATES
[J].
AHLRICHS, R
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER
AHLRICHS, R
;
LISCHKA, H
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER
LISCHKA, H
;
STAEMMLER, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER
STAEMMLER, V
;
KUTZELNIGG, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER
KUTZELNIGG, W
.
JOURNAL OF CHEMICAL PHYSICS,
1975,
62
(04)
:1225
-1234
[2]
BACKRACH SM, 1981, J CHEM PHYS, V75, P2270
[3]
NEW METHOD FOR OBSERVING THE ROTATIONAL SPECTRA OF WEAK MOLECULAR-COMPLEXES - KRHCL
[J].
BALLE, TJ
论文数:
0
引用数:
0
h-index:
0
机构:
Noyes Chemical Laboratory, University of Illinois, Urbana
BALLE, TJ
;
CAMPBELL, EJ
论文数:
0
引用数:
0
h-index:
0
机构:
Noyes Chemical Laboratory, University of Illinois, Urbana
CAMPBELL, EJ
;
KEENAN, MR
论文数:
0
引用数:
0
h-index:
0
机构:
Noyes Chemical Laboratory, University of Illinois, Urbana
KEENAN, MR
;
FLYGARE, WH
论文数:
0
引用数:
0
h-index:
0
机构:
Noyes Chemical Laboratory, University of Illinois, Urbana
FLYGARE, WH
.
JOURNAL OF CHEMICAL PHYSICS,
1979,
71
(06)
:2723
-2724
[4]
NEW METHOD FOR OBSERVING THE ROTATIONAL SPECTRA OF WEAK MOLECULAR-COMPLEXES - KRHCL
[J].
BALLE, TJ
论文数:
0
引用数:
0
h-index:
0
BALLE, TJ
;
CAMPBELL, EJ
论文数:
0
引用数:
0
h-index:
0
CAMPBELL, EJ
;
KEENAN, MR
论文数:
0
引用数:
0
h-index:
0
KEENAN, MR
;
FLYGARE, WH
论文数:
0
引用数:
0
h-index:
0
FLYGARE, WH
.
JOURNAL OF CHEMICAL PHYSICS,
1980,
72
(02)
:922
-932
[5]
MANY-BODY PERTURBATION-THEORY, COUPLED-PAIR MANY-ELECTRON THEORY, AND IMPORTANCE OF QUADRUPLE EXCITATIONS FOR CORRELATION PROBLEM
[J].
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
.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1978,
14
(05)
:561
-581
[6]
MOLECULAR APPLICATIONS OF COUPLED CLUSTER AND MANY-BODY PERTURBATION-METHODS
[J].
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
.
PHYSICA SCRIPTA,
1980,
21
(3-4)
:255
-265
[7]
BERYLLIUM DIMER, A CRITICAL TEST CASE OF MBPT AND CI METHODS
[J].
BLOMBERG, MRA
论文数:
0
引用数:
0
h-index:
0
BLOMBERG, MRA
;
SIEGBAHN, PEM
论文数:
0
引用数:
0
h-index:
0
SIEGBAHN, PEM
.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1978,
14
(05)
:583
-592
[8]
THE THEORY OF PULSED FOURIER-TRANSFORM MICROWAVE SPECTROSCOPY CARRIED OUT IN A FABRY-PEROT CAVITY - STATIC GAS
[J].
CAMPBELL, EJ
论文数:
0
引用数:
0
h-index:
0
CAMPBELL, EJ
;
BUXTON, LW
论文数:
0
引用数:
0
h-index:
0
BUXTON, LW
;
BALLE, TJ
论文数:
0
引用数:
0
h-index:
0
BALLE, TJ
;
FLYGARE, WH
论文数:
0
引用数:
0
h-index:
0
FLYGARE, WH
.
JOURNAL OF CHEMICAL PHYSICS,
1981,
74
(02)
:813
-828
[9]
AN EFFICIENT AND ACCURATE APPROXIMATION TO DOUBLE SUBSTITUTION COUPLED CLUSTER WAVEFUNCTIONS
[J].
CHILES, RA
论文数:
0
引用数:
0
h-index:
0
CHILES, RA
;
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
DYKSTRA, CE
.
CHEMICAL PHYSICS LETTERS,
1981,
80
(01)
:69
-72
[10]
BONDING IN THE MG4 CLUSTER - AN EXAMPLE OF CHEMICAL BONDING ORIGINATING FROM ELECTRON CORRELATION-EFFECTS
[J].
CHILES, RA
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
CHILES, RA
;
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
DYKSTRA, CE
;
JORDAN, KD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
JORDAN, KD
.
JOURNAL OF CHEMICAL PHYSICS,
1981,
75
(02)
:1044
-1046
←
1
2
3
4
→
共 32 条
[1]
PNO-CI (PAIR NATURAL ORBITAL CONFIGURATION INTERACTION) AND CEPA-PNO (COUPLED ELECTRON PAIR APPROXIMATION WITH PAIR NATURAL ORBITALS) CALCULATIONS OF MOLECULAR SYSTEMS .1. OUTLINE OF METHOD FOR CLOSED-SHELL STATES
[J].
AHLRICHS, R
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER
AHLRICHS, R
;
LISCHKA, H
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER
LISCHKA, H
;
STAEMMLER, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER
STAEMMLER, V
;
KUTZELNIGG, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER
KUTZELNIGG, W
.
JOURNAL OF CHEMICAL PHYSICS,
1975,
62
(04)
:1225
-1234
[2]
BACKRACH SM, 1981, J CHEM PHYS, V75, P2270
[3]
NEW METHOD FOR OBSERVING THE ROTATIONAL SPECTRA OF WEAK MOLECULAR-COMPLEXES - KRHCL
[J].
BALLE, TJ
论文数:
0
引用数:
0
h-index:
0
机构:
Noyes Chemical Laboratory, University of Illinois, Urbana
BALLE, TJ
;
CAMPBELL, EJ
论文数:
0
引用数:
0
h-index:
0
机构:
Noyes Chemical Laboratory, University of Illinois, Urbana
CAMPBELL, EJ
;
KEENAN, MR
论文数:
0
引用数:
0
h-index:
0
机构:
Noyes Chemical Laboratory, University of Illinois, Urbana
KEENAN, MR
;
FLYGARE, WH
论文数:
0
引用数:
0
h-index:
0
机构:
Noyes Chemical Laboratory, University of Illinois, Urbana
FLYGARE, WH
.
JOURNAL OF CHEMICAL PHYSICS,
1979,
71
(06)
:2723
-2724
[4]
NEW METHOD FOR OBSERVING THE ROTATIONAL SPECTRA OF WEAK MOLECULAR-COMPLEXES - KRHCL
[J].
BALLE, TJ
论文数:
0
引用数:
0
h-index:
0
BALLE, TJ
;
CAMPBELL, EJ
论文数:
0
引用数:
0
h-index:
0
CAMPBELL, EJ
;
KEENAN, MR
论文数:
0
引用数:
0
h-index:
0
KEENAN, MR
;
FLYGARE, WH
论文数:
0
引用数:
0
h-index:
0
FLYGARE, WH
.
JOURNAL OF CHEMICAL PHYSICS,
1980,
72
(02)
:922
-932
[5]
MANY-BODY PERTURBATION-THEORY, COUPLED-PAIR MANY-ELECTRON THEORY, AND IMPORTANCE OF QUADRUPLE EXCITATIONS FOR CORRELATION PROBLEM
[J].
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
.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1978,
14
(05)
:561
-581
[6]
MOLECULAR APPLICATIONS OF COUPLED CLUSTER AND MANY-BODY PERTURBATION-METHODS
[J].
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
.
PHYSICA SCRIPTA,
1980,
21
(3-4)
:255
-265
[7]
BERYLLIUM DIMER, A CRITICAL TEST CASE OF MBPT AND CI METHODS
[J].
BLOMBERG, MRA
论文数:
0
引用数:
0
h-index:
0
BLOMBERG, MRA
;
SIEGBAHN, PEM
论文数:
0
引用数:
0
h-index:
0
SIEGBAHN, PEM
.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1978,
14
(05)
:583
-592
[8]
THE THEORY OF PULSED FOURIER-TRANSFORM MICROWAVE SPECTROSCOPY CARRIED OUT IN A FABRY-PEROT CAVITY - STATIC GAS
[J].
CAMPBELL, EJ
论文数:
0
引用数:
0
h-index:
0
CAMPBELL, EJ
;
BUXTON, LW
论文数:
0
引用数:
0
h-index:
0
BUXTON, LW
;
BALLE, TJ
论文数:
0
引用数:
0
h-index:
0
BALLE, TJ
;
FLYGARE, WH
论文数:
0
引用数:
0
h-index:
0
FLYGARE, WH
.
JOURNAL OF CHEMICAL PHYSICS,
1981,
74
(02)
:813
-828
[9]
AN EFFICIENT AND ACCURATE APPROXIMATION TO DOUBLE SUBSTITUTION COUPLED CLUSTER WAVEFUNCTIONS
[J].
CHILES, RA
论文数:
0
引用数:
0
h-index:
0
CHILES, RA
;
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
DYKSTRA, CE
.
CHEMICAL PHYSICS LETTERS,
1981,
80
(01)
:69
-72
[10]
BONDING IN THE MG4 CLUSTER - AN EXAMPLE OF CHEMICAL BONDING ORIGINATING FROM ELECTRON CORRELATION-EFFECTS
[J].
CHILES, RA
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
CHILES, RA
;
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
DYKSTRA, CE
;
JORDAN, KD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
UNIV PITTSBURGH,DEPT CHEM,PITTSBURGH,PA 15260
JORDAN, KD
.
JOURNAL OF CHEMICAL PHYSICS,
1981,
75
(02)
:1044
-1046
←
1
2
3
4
→