2ND-ROW MOLECULAR-ORBITAL CALCULATIONS .2. SEMIEMPIRICAL CALCULATIONS OF DIPOLE-MOMENTS

被引：19

作者：

GORDON, MS ^{[1
]}

RICHARDS, B ^{[1
]}

KORTH, M ^{[1
]}

机构：

[1] N DAKOTA STATE UNIV,DEPT CHEM,FARGO,ND 58102

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1975年 / 28卷 / 02期

关键词：

D O I：

10.1016/0022-2860(75)80096-2

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

页码：255 / 267

页数：13

共 42 条

[1]

ALLAVENA M, 1972, J MOL STRUCT, V4, P439

[2] SCF-MO CALCULATIONS OF SOME MOLECULAR PROPERTIES OF ISOELECTRONIC SERIES FCL, HOCL, NH2CL AND CH3CL [J].

BENDAZZOLI, GL ;

LISTER, DG ;

PALMIERI, P .

JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS II, 1973, 69 (06) :791-797

[3] APPLICATIONS OF INDO METHOD TO SOME RADICALS CONTAINING SECOND ROW ELEMENTS [J].

BENSON, HG ;

HUDSON, A .

THEORETICA CHIMICA ACTA, 1971, 23 (03) :259-&

[4] INDO STUDY OF HYPERFINE COUPLING-CONSTANTS AND EQUILIBRIUM GEOMETRIES OF SOME TETRA-ATOMIC RADICALS [J].

BIDDLES, I ;

HUDSON, A .

MOLECULAR PHYSICS, 1973, 25 (03) :707-712

[5] MOLECULAR SCF CALCULATIONS FOR SIH4 AND H2S [J].

BOER, FP ;

LIPSCOMB, WN .

JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (02) :989-&

[6] MOLECULAR SCF CALCULATIONS ON PH3 PO PO- AND P2 [J].

BOYD, DB ;

LIPSCOMB, WN .

JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (03) :910-&

[7]

BOYD RJ, 1972, J CHEM SOC DA, P72

[8] APPROXIMATE MOLECULAR ORBITAL THEORY FOR INORGANIC MOLECULES .2. METHODS OF EVALUATING BASIC PARAMETERS [J].

BROWN, RD ;

ROBY, KR .

THEORETICA CHIMICA ACTA, 1970, 16 (03) :194-+

[9] DIPOLE-MOMENT DERIVATIVES AND VIBRATIONAL INTENSITIES OF BCL3 [J].

BRUNS, RE ;

KUZNESOF, PM .

JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (08) :4362-4366

[10] VIBRATIONAL INTENSITIES OF F2CS AND CL2CS [J].

BRUNS, RE .

JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (05) :1855-1860

← 1 2 3 4 5 →