CALCULATION OF RAMAN INTENSITIES BY A MODIFIED CNDO-2-INDO METHOD

被引：14

作者：

BLECKMANN, P

WIEGELER, W

机构：

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1977年 / 42卷 / DEC期

关键词：

D O I：

10.1016/0022-2860(77)87044-0

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：227 / 234

页数：8

共 12 条

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[2]

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[5]

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[6] APPROXIMATE SELF-CONSISTENT MOLECULAR ORBITAL THEORY .2. CALCULATIONS WITH COMPLETE NEGLECT OF DIFFERENTIAL OVERLAP [J].

POPLE, JA ;

SEGAL, GA .

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[7] APPROXIMATE SELF-CONSISTENT MOLECULAR-ORBITAL THEORY .5. INTERMEDIATE NEGLECT OF DIFFERENTIAL OVERLAP [J].

POPLE, JA ;

BEVERIDGE, DL ;

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JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (06) :2026-+

[8] CALCULATION OF INFRARED INTENSITIES BY CNDO METHOD [J].

SEGAL, GA ;

KLEIN, ML .

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[9]

Tang J., 1970, RAMAN SPECTROSCOPY, V2

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