THE MALONALDEHYDE EQUILIBRIUM GEOMETRY - A MAJOR STRUCTURAL SHIFT DUE TO THE EFFECTS OF ELECTRON CORRELATION

被引：166

作者：

FRISCH, MJ

SCHEINER, AC

SCHAEFER, HF

BINKLEY, JS

机构：

[1] UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB, BERKELEY, CA 94720 USA

[2] SANDIA NATL LABS, LIVERMORE, CA 94550 USA

来源：

JOURNAL OF CHEMICAL PHYSICS | 1985年 / 82卷 / 09期

关键词：

D O I：

10.1063/1.448861

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：4194 / 4198

页数：5

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