HARTREE-FOCK DESCRIPTIONS OF 1,3-DIPOLES - ZWITTERIONS, 1,3-DIRADICALS, OR HYPERVALENT SPECIES

被引：128

作者：

KAHN, SD

HEHRE, WJ

POPLE, JA

机构：

[1] UNIV CALIF IRVINE,DEPT CHEM,IRVINE,CA 92717

[2] CARNEGIE MELLON UNIV,DEPT CHEM,PITTSBURGH,PA 15213

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1987年 / 109卷 / 06期

关键词：

D O I：

10.1021/ja00240a053

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：1871 / 1873

页数：3

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[6] EXPANSION OF MOLECULAR-ORBITAL WAVE-FUNCTIONS INTO VALENCE BOND WAVE-FUNCTIONS - SIMPLIFIED PROCEDURE [J].

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[10]

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