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EFFECT OF CHOICE OF BASIS SET IN MOLECULAR PSEUDOPOTENTIAL CALCULATIONS
被引:6
作者
:
HARKER, AH
论文数:
0
引用数:
0
h-index:
0
机构:
ATOM ENERGY RES ESTAB,DIV THEORET PHYS,HARWELL,OXFORDSHIRE,ENGLAND
ATOM ENERGY RES ESTAB,DIV THEORET PHYS,HARWELL,OXFORDSHIRE,ENGLAND
HARKER, AH
[
1
]
机构
:
[1]
ATOM ENERGY RES ESTAB,DIV THEORET PHYS,HARWELL,OXFORDSHIRE,ENGLAND
来源
:
MOLECULAR PHYSICS
|
1976年
/ 32卷
/ 02期
关键词
:
D O I
:
10.1080/00268977600103331
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:583 / 586
页数:4
相关论文
共 6 条
[1]
BONIFACIC V, 1975, J CHEM PHYS, V62, P1509, DOI 10.1063/1.430614
[2]
ATOMIC AND MOLECULAR CALCULATIONS WITH MODEL POTENTIAL METHOD .2.
BONIFACIC, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
BONIFACIC, V
HUZINAGA, S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
HUZINAGA, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1975,
62
(04)
: 1507
-
1508
[3]
ATOMIC AND MOLECULAR CALCULATIONS WITH MODEL POTENTIAL METHOD .1.
BONIFACIC, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA, DEPT CHEM, EDMONTON, ALBERTA, CANADA
UNIV ALBERTA, DEPT CHEM, EDMONTON, ALBERTA, CANADA
BONIFACIC, V
HUZINAGA, S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA, DEPT CHEM, EDMONTON, ALBERTA, CANADA
UNIV ALBERTA, DEPT CHEM, EDMONTON, ALBERTA, CANADA
HUZINAGA, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1974,
60
(07)
: 2779
-
2786
[4]
Clementi E., 1974, Atomic Data and Nuclear Data Tables, V14, P177, DOI 10.1016/S0092-640X(74)80016-1
[5]
GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I.
HUZINAGA, S
论文数:
0
引用数:
0
h-index:
0
HUZINAGA, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(04)
: 1293
-
&
[6]
SMALL GAUSSIAN EXPANSIONS OF SLATER-TYPE ORBITALS
STEWART, RF
论文数:
0
引用数:
0
h-index:
0
STEWART, RF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(01)
: 431
-
&
←
1
→
共 6 条
[1]
BONIFACIC V, 1975, J CHEM PHYS, V62, P1509, DOI 10.1063/1.430614
[2]
ATOMIC AND MOLECULAR CALCULATIONS WITH MODEL POTENTIAL METHOD .2.
BONIFACIC, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
BONIFACIC, V
HUZINAGA, S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
UNIV ALBERTA,DEPT CHEM,EDMONTON,ALBERTA,CANADA
HUZINAGA, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1975,
62
(04)
: 1507
-
1508
[3]
ATOMIC AND MOLECULAR CALCULATIONS WITH MODEL POTENTIAL METHOD .1.
BONIFACIC, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA, DEPT CHEM, EDMONTON, ALBERTA, CANADA
UNIV ALBERTA, DEPT CHEM, EDMONTON, ALBERTA, CANADA
BONIFACIC, V
HUZINAGA, S
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ALBERTA, DEPT CHEM, EDMONTON, ALBERTA, CANADA
UNIV ALBERTA, DEPT CHEM, EDMONTON, ALBERTA, CANADA
HUZINAGA, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1974,
60
(07)
: 2779
-
2786
[4]
Clementi E., 1974, Atomic Data and Nuclear Data Tables, V14, P177, DOI 10.1016/S0092-640X(74)80016-1
[5]
GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I.
HUZINAGA, S
论文数:
0
引用数:
0
h-index:
0
HUZINAGA, S
[J].
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(04)
: 1293
-
&
[6]
SMALL GAUSSIAN EXPANSIONS OF SLATER-TYPE ORBITALS
STEWART, RF
论文数:
0
引用数:
0
h-index:
0
STEWART, RF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(01)
: 431
-
&
←
1
→