LCAO-MO-description of the different association types of formic acid

被引：32

作者：

Schuster, P. ^{[1
]}

Funck, Th. ^{[1
]}

机构：

[1] Max Planck Inst Phys Chem, Gottingen, Germany

来源：

CHEMICAL PHYSICS LETTERS | 1968年 / 2卷 / 08期

关键词：

D O I：

10.1016/0009-2614(63)80023-8

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 results of CNDO/2-calculations for formic acid and for different types of its association are presented. No delocalization energy is found that favours the cyclic dimer over the open chain associates.

引用

页码：587 / 588

页数：2

共 11 条

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