MOLECULAR FRAGMENTS OR CHEMICAL BONDS

被引：235

作者：

BADER, RFW ^{[1
]}

机构：

[1] MCMASTER UNIV, DEPT CHEM, HAMILTON L8S 4M, ONTARIO, CANADA

来源：

ACCOUNTS OF CHEMICAL RESEARCH | 1975年 / 8卷 / 01期

关键词：

D O I：

10.1021/ar50085a005

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：34 / 40

页数：7

共 19 条

[1]

Bader R.F.W., 1969, INT J QUANTUM CHEM, V3, P327, DOI [10.1002/qua.560030308, DOI 10.1002/QUA.560030308]

[2] THEORETICAL DEVELOPMENT OF A VIRIAL RELATIONSHIP FOR SPATIALLY DEFINED FRAGMENTS OF MOLECULAR SYSTEMS [J].

BADER, RFW ;

BEDDALL, PM ;

PESLAK, J .

JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (02) :557-566

[3] VIRIAL PARTITIONING OF CHARGE-DISTRIBUTIONS AND PROPERTIES OF DIATOMIC HYDRIDES - NAH[-]HCL [J].

BADER, RFW ;

MESSER, RR .

CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 1974, 52 (12) :2268-2282

[4] INTERPRETATION OF CHARGE AND ENERGY CHANGES IN 2 NUCLEOPHILIC DISPLACEMENT REACTIONS [J].

BADER, RFW ;

DUKE, AJ ;

MESSER, RR .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (23) :7715-7721

[5] PARTITIONING AND CHARACTERIZATION OF MOLECULAR CHARGE DISTRIBUTIONS [J].

BADER, RFW ;

BEDDALL, PM ;

CADE, PE .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1971, 93 (13) :3095-+

[6] MOLECULAR CHARGE DISTRIBUTIONS AND CHEMICAL BINDING [J].

BADER, RFW ;

HENNEKER, WH ;

CADE, PE .

JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (09) :3341-&

[7] VIRIAL PARTITIONING OF CHARGE DISTRIBUTIONS AND PROPERTIES OF DIATOMIC HYDRIDES [J].

BADER, RFW ;

BEDDALL, PM .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (02) :305-315

[8] VIRIAL FIELD RELATIONSHIP FOR MOLECULAR CHARGE DISTRIBUTIONS AND SPATIAL PARTITIONING OF MOLECULAR PROPERTIES [J].

BADER, RFW ;

BEDDALL, PM .

JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (07) :3320-+

[9] MOLECULAR SCF CALCULATIONS FOR GROUND STATE OF SOME 3-MEMBERED RING MOLECULES - (CH2)3, (CH2)2NH, (CH2)2NH2+, (CH2)2O, (CH2)2S, (CH)2CH2, AND N2CH2 [J].

BONACCOR.R ;

SCROCCO, E ;

TOMASI, J .

JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (10) :5270-&

[10] MOLECULAR ELECTROSTATIC POTENTIALS FOR NUCLEIC-ACID BASES - ADENINE, THYMINE, AND CYTOSINE [J].

BONACCORSI, R ;

TOMASI, J ;

SCROCCO, E ;

PULLMAN, A .

THEORETICA CHIMICA ACTA, 1972, 24 (01) :51-+

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