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FINITE-DIFFERENCE SOLUTION OF HARTREE-FOCK EQUATIONS FOR DIATOMIC-MOLECULES
被引:4
作者
:
FIMPLE, WR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CANTERBURY,DEPT PHYS,CHRISTCHURCH,NEW ZEALAND
UNIV CANTERBURY,DEPT PHYS,CHRISTCHURCH,NEW ZEALAND
FIMPLE, WR
[
1
]
WHITE, SP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CANTERBURY,DEPT PHYS,CHRISTCHURCH,NEW ZEALAND
UNIV CANTERBURY,DEPT PHYS,CHRISTCHURCH,NEW ZEALAND
WHITE, SP
[
1
]
机构
:
[1]
UNIV CANTERBURY,DEPT PHYS,CHRISTCHURCH,NEW ZEALAND
来源
:
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
|
1975年
/ 9卷
/ 02期
关键词
:
D O I
:
10.1002/qua.560090210
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:301 / 324
页数:24
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[J].
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RANSIL, BJ
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[J].
JOURNAL OF CHEMICAL PHYSICS,
1961,
35
(06)
: 1967
-
&
[3]
NUMERICAL SOLUTION OF HARTREE-FOCK EQUATIONS
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&
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[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
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: 819
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834
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The deferred approach to the limit. Part I. Single lattice. Part II. Interpenetrating lattices.
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[J].
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1927,
226
: 299
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←
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共 16 条
[1]
AB-INITIO SCF-MO-CI CALCULATIONS FOR H-, H2, AND H3+ USING GAUSSIAN BASIS SETS
CSIZMADIA, IG
论文数:
0
引用数:
0
h-index:
0
CSIZMADIA, IG
KARI, RE
论文数:
0
引用数:
0
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0
KARI, RE
POLANYI, JC
论文数:
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POLANYI, JC
ROACH, AC
论文数:
0
引用数:
0
h-index:
0
ROACH, AC
ROBB, MA
论文数:
0
引用数:
0
h-index:
0
ROBB, MA
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(12)
: 6205
-
+
[2]
STUDIES IN MOLECULAR STRUCTURE .6. POTENTIAL CURVE FOR INTERACTION OF 2 HYDROGEN ATOMS IN LCAO MO SCF APPROXIMATION
FRAGA, S
论文数:
0
引用数:
0
h-index:
0
FRAGA, S
RANSIL, BJ
论文数:
0
引用数:
0
h-index:
0
RANSIL, BJ
[J].
JOURNAL OF CHEMICAL PHYSICS,
1961,
35
(06)
: 1967
-
&
[3]
NUMERICAL SOLUTION OF HARTREE-FOCK EQUATIONS
FROESE, C
论文数:
0
引用数:
0
h-index:
0
FROESE, C
[J].
CANADIAN JOURNAL OF PHYSICS,
1963,
41
(11)
: 1895
-
&
[4]
HELIUM-ATOM-HYDROGEN-MOLECULE POTENTIAL SURFACE EMPLOYING LCAO-MO-SCF AND CI METHODS
GORDON, MD
论文数:
0
引用数:
0
h-index:
0
GORDON, MD
SECREST, D
论文数:
0
引用数:
0
h-index:
0
SECREST, D
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(01)
: 120
-
&
[5]
NONINTEGRAL ELLIPTICAL ORBITAL STUDIES ON H2+ H2 AND HEH+
HOYLAND, JR
论文数:
0
引用数:
0
h-index:
0
HOYLAND, JR
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
45
(02)
: 466
-
&
[6]
ACCURATE ELECTRONIC WAVE FUNCTIONS FOR THE H-2 MOLECULE
KOLOS, W
论文数:
0
引用数:
0
h-index:
0
KOLOS, W
ROOTHAAN, CCJ
论文数:
0
引用数:
0
h-index:
0
ROOTHAAN, CCJ
[J].
REVIEWS OF MODERN PHYSICS,
1960,
32
(02)
: 219
-
232
[7]
KOPAL Z, 1961, NUMERICAL ANALYSIS
[8]
MOLECULAR-ORBITAL STUDIES ON SMALL MOLECULES USING H+/2-TYPE ELLIPTICAL BASIS ORBITALS - APPLICATION TO H+/2, H2, HE+/2+ AND H+-3
LLAGUNO, CT
论文数:
0
引用数:
0
h-index:
0
机构:
BROCK UNIV, DEPT CHEM, ST CATHARINES, ONTARIO, CANADA
BROCK UNIV, DEPT CHEM, ST CATHARINES, ONTARIO, CANADA
LLAGUNO, CT
GUPTA, SK
论文数:
0
引用数:
0
h-index:
0
机构:
BROCK UNIV, DEPT CHEM, ST CATHARINES, ONTARIO, CANADA
BROCK UNIV, DEPT CHEM, ST CATHARINES, ONTARIO, CANADA
GUPTA, SK
ROTHSTEIN, SM
论文数:
0
引用数:
0
h-index:
0
机构:
BROCK UNIV, DEPT CHEM, ST CATHARINES, ONTARIO, CANADA
BROCK UNIV, DEPT CHEM, ST CATHARINES, ONTARIO, CANADA
ROTHSTEIN, SM
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1973,
7
(04)
: 819
-
834
[9]
Neville E.H., 1934, J INDIAN MATH SOC, V20, P87
[10]
The deferred approach to the limit. Part I. Single lattice. Part II. Interpenetrating lattices.
Richardson, LF
论文数:
0
引用数:
0
h-index:
0
Richardson, LF
Gaunt, JA
论文数:
0
引用数:
0
h-index:
0
Gaunt, JA
[J].
PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY OF LONDON SERIES A-CONTAINING PAPERS OF A MATHEMATICAL OR PHYSICAL CHARACTER,
1927,
226
: 299
-
361
←
1
2
→