SIMPLE MECHANICAL MODEL FOR MOLECULAR GEOMETRY BASED ON HELLMANN-FEYNMAN THEOREM .1. GENERAL PRINCIPLES AND APPLICATIONS TO AH2, AH3, AH4, AB2, HAB, AND ABC MOLECULES

被引：53
作者：
DEB, BM [1 ]
机构：
[1] INDIAN INST TECHNOL,DEPT CHEM,BOMBAY,INDIA
来源：
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1974年 / 96卷 / 07期
关键词：
D O I：
10.1021/ja00814a009
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
引用
收藏
页码：2030 / 2044
页数：15
相关论文
共 110 条
[1]   EXTENDED HUCKEL THEORY AND SHAPE OF MOLECULES [J].
ALLEN, LC ;
RUSSELL, JD .
JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (03) :1029-&
[2]   AB-INITIO STUDY OF GEOMETRIES, JAHN-TELLER DISTORTIONS, AND ELECTRONIC CHARGE DISTRIBUTION IN CH4+ION [J].
ARENTS, J ;
ALLEN, LC .
JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (01) :73-&
[3]   MOLECULAR GEOMETRY - BONDED VERSUS NONBONDED INTERACTIONS [J].
BARTELL, LS .
JOURNAL OF CHEMICAL EDUCATION, 1968, 45 (12) :754-+
[4]   TANGENT-SPHERE MODELS OF MOLECULES .6. ION-PACKING MODELS OF COVALENT COMPOUNDS [J].
BENT, HA .
JOURNAL OF CHEMICAL EDUCATION, 1968, 45 (12) :768-&
[5]   TANGENT-SPHERE MODELS OF MOLECULES .4. ESTIMATION OF INTERNUCLEAR DISTANCES - ELECTRONIC STRUCTURE OF METALS [J].
BENT, HA .
JOURNAL OF CHEMICAL EDUCATION, 1965, 42 (07) :348-&
[6]  
BENT HA, 1963, J CHEM EDUC, V40, P523
[7]  
BENT HA, 1963, J CHEM EDUC, V40, P446
[8]   MOLECULAR-ORBITAL THEORY OF GEOMETRY AND HYPERFINE COUPLING CONSTANTS OF FLUORINATED METHYL RADICALS [J].
BEVERIDGE, DL ;
DOBOSH, PA ;
POPLE, JA .
JOURNAL OF CHEMICAL PHYSICS, 1968, 48 (10) :4802-+
[9]   CHARGE-TRANSFER INTERACTION BETWEEN IODINE AND POLYNUCLEAR AROMATIC HYDROCARBONS [J].
BHATTACHARYA, R ;
BASU, S .
TRANSACTIONS OF THE FARADAY SOCIETY, 1958, 54 (09) :1286-1290
[10]   MOLECULAR SCF CALCULATIONS FOR SIH4 AND H2S [J].
BOER, FP ;
LIPSCOMB, WN .
JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (02) :989-&
12345678910