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EVALUATION OF ONE-CENTRE COULOMB INTEGRALS IN SEMI-EMPIRICAL MOLECULAR ORBITAL THEORY
被引:5
作者
:
BOYD, RJ
论文数:
0
引用数:
0
h-index:
0
BOYD, RJ
WHITEHEA.MA
论文数:
0
引用数:
0
h-index:
0
WHITEHEA.MA
机构
:
来源
:
JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL
|
1970年
/ 15期
关键词
:
D O I
:
10.1039/j19700002469
中图分类号
:
O6 [化学];
学科分类号
:
0703 ;
摘要
:
引用
收藏
页码:2469 / &
相关论文
共 23 条
[1]
ATOMIC SHIELDING PARAMETERS
[J].
BURNS, G
论文数:
0
引用数:
0
h-index:
0
BURNS, G
.
JOURNAL OF CHEMICAL PHYSICS,
1964,
41
(05)
:1521
-&
[2]
ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
RAIMONDI, DL
论文数:
0
引用数:
0
h-index:
0
RAIMONDI, DL
.
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(11)
:2686
-&
[3]
NOTE ON AN INTEGRAL OF AF SATURNO
[J].
COULSON, CA
论文数:
0
引用数:
0
h-index:
0
COULSON, CA
.
THEORETICA CHIMICA ACTA,
1968,
12
(04)
:341
-&
[4]
SLATER-CONDON PARAMETERS EVALUATED FROM ANALYTICAL HARTREE-FOCK FUNCTIONS
[J].
FISK, C
论文数:
0
引用数:
0
h-index:
0
FISK, C
;
FRAGA, S
论文数:
0
引用数:
0
h-index:
0
FRAGA, S
.
CANADIAN JOURNAL OF PHYSICS,
1968,
46
(09)
:1140
-&
[5]
FISK C, TC6601 TECHN REP
[6]
FISK C, TC6801 TECHN REP
[7]
ELECTRONEGATIVITY .1. ORBITAL ELECTRONEGATIVITY OF NEUTRAL ATOMS
[J].
HINZE, J
论文数:
0
引用数:
0
h-index:
0
HINZE, J
;
JAFFE, HH
论文数:
0
引用数:
0
h-index:
0
JAFFE, HH
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1962,
84
(04)
:540
-&
[8]
ELECTRONEGATIVITY .6. ORBITAL ELECTRONEGATIVITIES OF NEUTRAL ATOMS OF PERIODS 3 APERIODS 1 AND
[J].
HINZE, J
论文数:
0
引用数:
0
h-index:
0
HINZE, J
;
JAFFE, HH
论文数:
0
引用数:
0
h-index:
0
JAFFE, HH
.
JOURNAL OF PHYSICAL CHEMISTRY,
1963,
67
(07)
:1501
-&
[9]
EVALUATION OF ONE-CENTRE INTEGRALS IN SEMI-EMPIRICAL MOLECULAR ORBITAL THEORY
[J].
OLEARI, L
论文数:
0
引用数:
0
h-index:
0
OLEARI, L
;
DISIPIO, L
论文数:
0
引用数:
0
h-index:
0
DISIPIO, L
;
DEMICHEL.G
论文数:
0
引用数:
0
h-index:
0
DEMICHEL.G
.
MOLECULAR PHYSICS,
1966,
10
(02)
:97
-&
[10]
AN IMPROVEMENT IN THE PI-ELECTRON APPROXIMATION IN LCAO MO THEORY
[J].
PARISER, R
论文数:
0
引用数:
0
h-index:
0
PARISER, R
.
JOURNAL OF CHEMICAL PHYSICS,
1953,
21
(03)
:568
-569
←
1
2
3
→
共 23 条
[1]
ATOMIC SHIELDING PARAMETERS
[J].
BURNS, G
论文数:
0
引用数:
0
h-index:
0
BURNS, G
.
JOURNAL OF CHEMICAL PHYSICS,
1964,
41
(05)
:1521
-&
[2]
ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
RAIMONDI, DL
论文数:
0
引用数:
0
h-index:
0
RAIMONDI, DL
.
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(11)
:2686
-&
[3]
NOTE ON AN INTEGRAL OF AF SATURNO
[J].
COULSON, CA
论文数:
0
引用数:
0
h-index:
0
COULSON, CA
.
THEORETICA CHIMICA ACTA,
1968,
12
(04)
:341
-&
[4]
SLATER-CONDON PARAMETERS EVALUATED FROM ANALYTICAL HARTREE-FOCK FUNCTIONS
[J].
FISK, C
论文数:
0
引用数:
0
h-index:
0
FISK, C
;
FRAGA, S
论文数:
0
引用数:
0
h-index:
0
FRAGA, S
.
CANADIAN JOURNAL OF PHYSICS,
1968,
46
(09)
:1140
-&
[5]
FISK C, TC6601 TECHN REP
[6]
FISK C, TC6801 TECHN REP
[7]
ELECTRONEGATIVITY .1. ORBITAL ELECTRONEGATIVITY OF NEUTRAL ATOMS
[J].
HINZE, J
论文数:
0
引用数:
0
h-index:
0
HINZE, J
;
JAFFE, HH
论文数:
0
引用数:
0
h-index:
0
JAFFE, HH
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1962,
84
(04)
:540
-&
[8]
ELECTRONEGATIVITY .6. ORBITAL ELECTRONEGATIVITIES OF NEUTRAL ATOMS OF PERIODS 3 APERIODS 1 AND
[J].
HINZE, J
论文数:
0
引用数:
0
h-index:
0
HINZE, J
;
JAFFE, HH
论文数:
0
引用数:
0
h-index:
0
JAFFE, HH
.
JOURNAL OF PHYSICAL CHEMISTRY,
1963,
67
(07)
:1501
-&
[9]
EVALUATION OF ONE-CENTRE INTEGRALS IN SEMI-EMPIRICAL MOLECULAR ORBITAL THEORY
[J].
OLEARI, L
论文数:
0
引用数:
0
h-index:
0
OLEARI, L
;
DISIPIO, L
论文数:
0
引用数:
0
h-index:
0
DISIPIO, L
;
DEMICHEL.G
论文数:
0
引用数:
0
h-index:
0
DEMICHEL.G
.
MOLECULAR PHYSICS,
1966,
10
(02)
:97
-&
[10]
AN IMPROVEMENT IN THE PI-ELECTRON APPROXIMATION IN LCAO MO THEORY
[J].
PARISER, R
论文数:
0
引用数:
0
h-index:
0
PARISER, R
.
JOURNAL OF CHEMICAL PHYSICS,
1953,
21
(03)
:568
-569
←
1
2
3
→