HARTREE-FOCK THEORY OF LOCAL REGIONS IN MOLECULES

被引：34

作者：

PAYNE, PW

机构：

[1] UNIV N CAROLINA, DEPT CHEM, CHAPEL HILL, NC 27514 USA

[2] PRINCETON UNIV, DEPT CHEM, PRINCETON, NJ 08540 USA

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1977年 / 99卷 / 11期

关键词：

D O I：

10.1021/ja00453a044

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：3787 / 3794

页数：8

共 155 条

[61] LOCALIZED CHARGE DISTRIBUTIONS .5. INTERNAL-ROTATION BARRIERS IN METHYLAMINE, METHYL-ALCOHOL, PROPENE, AND ACETALDEHYDE
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[J]. CHEMICAL PHYSICS LETTERS, 1972, 15 (01) : 59 - &
[63] LOCALIZED CHARGE-DISTRIBUTIONS .6. INTERNAL-ROTATION IN FORMALDOXIME AND FORMIC-ACID
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[J]. JOURNAL OF MOLECULAR STRUCTURE, 1974, 23 (03) : 399 - 410
[64] ORBITAL INTERACTIONS IN METAL DIMER COMPLEXES
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (17) : 4884 - 4899
[65] INTERCONVERTING CYCLOPROPYLCARBINYL CATIONS
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (01) : 302 - 304
[66] CONFORMATION OF VINYLIC METHYL GROUPS
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[67] HOMOAROMATIC STABILITY
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (17) : 5807 - 5809
[68] THEORETICAL APPROACHES TO REARRANGEMENTS IN CARBOCATIONS .1. HALOETHYL SYSTEM
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (09) : 2665 - 2677
[69] QUANTITATIVE ASSESSMENT OF THROUGH-SPACE AND THROUGH-BOND INTERACTIONS - APPLICATION TO SEMIEMPIRICAL SCF MODELS
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[J]. HELVETICA CHIMICA ACTA, 1975, 58 (03) : 936 - 967
[70] CONSEQUENCES OF SUBSTITUTION IN PHOTOELECTRON-SPECTRA OF [2,2]PARACYCLOPHANES - SEPARATION OF THROUGH-SPACE AND THROUGH-BOND INTERACTIONS AS A CONSEQUENCE OF FLUOROSUBSTITUTION
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[J]. HELVETICA CHIMICA ACTA, 1974, 57 (01) : 151 - 159

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