HARDNESS PROFILE OF A REACTION-PATH

被引：120

作者：

DATTA, D

机构：

[1] Department of Inorganic Chemistry, Indian Association for the Cultivation of Science

来源：

JOURNAL OF PHYSICAL CHEMISTRY | 1992年 / 96卷 / 06期

关键词：

D O I：

10.1021/j100185a005

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：

The variation of the hardness of a chemical species along a reaction path, which we call the "hardness profile", is shown to go through a minima at the transition state. The hardness values are calculated by the MNDO method.

引用

页码：2409 / 2410

页数：2

共 8 条

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