FAILURE OF CNDO-2 METHOD FOR PREDICTING CONFORMATIONS IN SOME SYSTEMS WITH LOCALIZED BONDS

被引：37

作者：

VEILLARD, A ^{[1
]}

机构：

[1] CNRS,F-67000 STRASBOURG,FRANCE

来源：

CHEMICAL PHYSICS LETTERS | 1975年 / 33卷 / 01期

关键词：

D O I：

10.1016/0009-2614(75)85443-1

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：15 / 17

页数：3

共 39 条

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[6] MICROWAVE SPECTRUM, STRUCTURE, DIPOLE MOMENT, AND QUADRUPOLE COUPLING CONSTANTS OF AMINODIFLUOROPHOSPHINE
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[8] AB-INITIO MOLECULAR-ORBITAL CALCULATIONS ON H2NPH2 - STEREOCHEMISTRY AT NITROGEN
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[9] MICROWAVE-SPECTRUM, STRUCTURE, AND DIPOLE-MOMENT OF BIPHOSPHINE-4
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (09) : 2688 - 2693
[10] OPEN-SHELL INTERACTIONS, NONBONDED ATTRACTION, AND AROMATICITY - IMPLICATIONS FOR REGIOCHEMISTRY
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (13) : 4075 - 4084

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