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AB-INITIO SCF AND CI STUDY OF ELECTRONIC-STRUCTURE OF BH3CO
被引:11
作者
:
HA, TK
论文数:
0
引用数:
0
h-index:
0
机构:
SWISS FED INST TECHNOL,LAB PHYS CHEM,ZURICH,SWITZERLAND
SWISS FED INST TECHNOL,LAB PHYS CHEM,ZURICH,SWITZERLAND
HA, TK
[
1
]
机构
:
[1]
SWISS FED INST TECHNOL,LAB PHYS CHEM,ZURICH,SWITZERLAND
来源
:
JOURNAL OF MOLECULAR STRUCTURE
|
1976年
/ 30卷
/ 01期
关键词
:
D O I
:
10.1016/0022-2860(76)85050-8
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:103 / 111
页数:9
相关论文
共 31 条
[21]
MULLIKEN RS, 1969, MOLECULAR COMPLEX
[22]
INFLUENCE OF HYPERCONJUGATION ON PROPERTIES OF BORANE ADDUCTS
PURCELL, KF
论文数:
0
引用数:
0
h-index:
0
机构:
KANSAS STATE UNIV,DEPT CHEM,MANHATTAN,KS 66502
KANSAS STATE UNIV,DEPT CHEM,MANHATTAN,KS 66502
PURCELL, KF
MARTIN, RL
论文数:
0
引用数:
0
h-index:
0
机构:
KANSAS STATE UNIV,DEPT CHEM,MANHATTAN,KS 66502
KANSAS STATE UNIV,DEPT CHEM,MANHATTAN,KS 66502
MARTIN, RL
[J].
THEORETICA CHIMICA ACTA,
1974,
35
(02):
: 141
-
149
[23]
SIGMA AND PI BINDING EFFECTS IN COORDINATION OF CARBON MONOXIDE AND COMPARISON WITH CYANIDE ION
PURCELL, KF
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Kansas State University, Manhattan
PURCELL, KF
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1969,
91
(13)
: 3487
-
&
[24]
STANDBERG MWP, 1949, J CHEM PHYS, V17, P429
[25]
RAMAN SPECTRA, VIBRATIONAL ASSIGNMENTS, AND FORCE CONSTANTS FOR BH3CO AND BD3CO
TAYLOR, RC
论文数:
0
引用数:
0
h-index:
0
TAYLOR, RC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1957,
26
(05)
: 1131
-
1135
[26]
NUCLEAR QUADRUPOLE EFFECTS AND ELECTRONIC STRUCTURE OF MOLECULES IN THE SOLID STATE
TOWNES, CH
论文数:
0
引用数:
0
h-index:
0
TOWNES, CH
DAILEY, BP
论文数:
0
引用数:
0
h-index:
0
DAILEY, BP
[J].
JOURNAL OF CHEMICAL PHYSICS,
1952,
20
(01)
: 35
-
40
[27]
DETERMINATION OF ELECTRONIC STRUCTURE OF MOLECULES FROM NUCLEAR QUADRUPOLE EFFECTS
TOWNES, CH
论文数:
0
引用数:
0
h-index:
0
TOWNES, CH
DAILEY, BP
论文数:
0
引用数:
0
h-index:
0
DAILEY, BP
[J].
JOURNAL OF CHEMICAL PHYSICS,
1949,
17
(09)
: 782
-
796
[28]
CONFIGURATION INTERACTION STUDIES OF GROUND AND EXCITED STATES OF POLYATOMIC MOLECULES .1. CI FORMULATION AND STUDIES OF FORMALDEHYDE
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, State University of New York at Stony Brook, Stony Brook
WHITTEN, JL
HACKMEYE.M
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, State University of New York at Stony Brook, Stony Brook
HACKMEYE.M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(12)
: 5584
-
&
[29]
GAUSSIAN EXPANSION OF HYDROGEN-ATOM WAVEFUNCTIONS
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
WHITTEN, JL
[J].
JOURNAL OF CHEMICAL PHYSICS,
1963,
39
(02)
: 349
-
&
[30]
GAUSSIAN LOBE FUNCTION EXPANSIONS OF HARTREE-FOCK SOLUTIONS FOR FIRST-ROW ATOMS AND ETHYLENE
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
WHITTEN, JL
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(01)
: 359
-
&
←
1
2
3
4
→
共 31 条
[21]
MULLIKEN RS, 1969, MOLECULAR COMPLEX
[22]
INFLUENCE OF HYPERCONJUGATION ON PROPERTIES OF BORANE ADDUCTS
PURCELL, KF
论文数:
0
引用数:
0
h-index:
0
机构:
KANSAS STATE UNIV,DEPT CHEM,MANHATTAN,KS 66502
KANSAS STATE UNIV,DEPT CHEM,MANHATTAN,KS 66502
PURCELL, KF
MARTIN, RL
论文数:
0
引用数:
0
h-index:
0
机构:
KANSAS STATE UNIV,DEPT CHEM,MANHATTAN,KS 66502
KANSAS STATE UNIV,DEPT CHEM,MANHATTAN,KS 66502
MARTIN, RL
[J].
THEORETICA CHIMICA ACTA,
1974,
35
(02):
: 141
-
149
[23]
SIGMA AND PI BINDING EFFECTS IN COORDINATION OF CARBON MONOXIDE AND COMPARISON WITH CYANIDE ION
PURCELL, KF
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Kansas State University, Manhattan
PURCELL, KF
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1969,
91
(13)
: 3487
-
&
[24]
STANDBERG MWP, 1949, J CHEM PHYS, V17, P429
[25]
RAMAN SPECTRA, VIBRATIONAL ASSIGNMENTS, AND FORCE CONSTANTS FOR BH3CO AND BD3CO
TAYLOR, RC
论文数:
0
引用数:
0
h-index:
0
TAYLOR, RC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1957,
26
(05)
: 1131
-
1135
[26]
NUCLEAR QUADRUPOLE EFFECTS AND ELECTRONIC STRUCTURE OF MOLECULES IN THE SOLID STATE
TOWNES, CH
论文数:
0
引用数:
0
h-index:
0
TOWNES, CH
DAILEY, BP
论文数:
0
引用数:
0
h-index:
0
DAILEY, BP
[J].
JOURNAL OF CHEMICAL PHYSICS,
1952,
20
(01)
: 35
-
40
[27]
DETERMINATION OF ELECTRONIC STRUCTURE OF MOLECULES FROM NUCLEAR QUADRUPOLE EFFECTS
TOWNES, CH
论文数:
0
引用数:
0
h-index:
0
TOWNES, CH
DAILEY, BP
论文数:
0
引用数:
0
h-index:
0
DAILEY, BP
[J].
JOURNAL OF CHEMICAL PHYSICS,
1949,
17
(09)
: 782
-
796
[28]
CONFIGURATION INTERACTION STUDIES OF GROUND AND EXCITED STATES OF POLYATOMIC MOLECULES .1. CI FORMULATION AND STUDIES OF FORMALDEHYDE
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, State University of New York at Stony Brook, Stony Brook
WHITTEN, JL
HACKMEYE.M
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, State University of New York at Stony Brook, Stony Brook
HACKMEYE.M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(12)
: 5584
-
&
[29]
GAUSSIAN EXPANSION OF HYDROGEN-ATOM WAVEFUNCTIONS
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
WHITTEN, JL
[J].
JOURNAL OF CHEMICAL PHYSICS,
1963,
39
(02)
: 349
-
&
[30]
GAUSSIAN LOBE FUNCTION EXPANSIONS OF HARTREE-FOCK SOLUTIONS FOR FIRST-ROW ATOMS AND ETHYLENE
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
WHITTEN, JL
[J].
JOURNAL OF CHEMICAL PHYSICS,
1966,
44
(01)
: 359
-
&
←
1
2
3
4
→