SYMMETRY-BREAKING IN MOLECULAR CALCULATIONS AND THE RELIABLE PREDICTION OF EQUILIBRIUM GEOMETRIES - THE FORMYLOXYL RADICAL AS AN EXAMPLE

被引：158

作者：

MCLEAN, AD

LENGSFIELD, BH

PACANSKY, J

ELLINGER, Y

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1985年 / 83卷 / 07期

关键词：

D O I：

10.1063/1.449162

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

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页码：3567 / 3576

页数：10

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