Infrared spectra of hydrogen bond a general theoretical model

被引：140

作者：

Witkowski, Andrzej ^{[1
]}

Wojcik, Marek ^{[1
]}

机构：

[1] Jagiellonian Univ, Dept Theoret Chem, Krakow, Poland

来源：

CHEMICAL PHYSICS | 1973年 / 1卷 / 01期

关键词：

D O I：

10.1016/0301-0104(73)87017-X

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：

For the IR spectra of the hydrogen bond a general theoretical model is presented which puts on equal footing the Fermi resonance and the coupling between the high and low frequency modes. The fundamental hamiltonian is derived and its spectral consequences studied in detail. The theoretical IR spectra of the hydrogen bond are obtained and the relative roles of both mechanisms are quantitatively studied and discussed.

引用

页码：9 / 16

页数：8

共 15 条

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