THEORETICAL PREDICTION OF THE VIBRATIONAL-SPECTRUM, GEOMETRY, AND SCALED QUANTUM-MECHANICAL FORCE-FIELD FOR PHENYLACETYLENE

被引：40

作者：

CSASZAR, AG ^{[1
]}

FOGARASI, G ^{[1
]}

BOGGS, JE ^{[1
]}

机构：

[1] UNIV TEXAS, DEPT CHEM, AUSTIN, TX 78712 USA

来源：

JOURNAL OF PHYSICAL CHEMISTRY | 1989年 / 93卷 / 22期

关键词：

D O I：

10.1021/j100359a023

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

收藏

页码：7644 / 7651

页数：8

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[54] THE COMPUTED FORCE-CONSTANTS AND VIBRATIONAL-SPECTRA OF TOLUENE
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