HARMONIC 2-PHOTON INTENSITY SUM-RULE FOR BENZENE-B2U MODES

被引:11
作者
OZKABAK, AG
GOODMAN, L
BERMAN, JM
机构
[1] Wright and Rieman Chemistry Laboratories, Rutgers, The State University of New Jersey, New Brunswick
基金
美国国家科学基金会;
关键词
D O I
10.1016/0009-2614(90)85606-D
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
A harmonic two-photon cross section sum rule for benzene b2u modes (ν14 and ν15) in the Ã1B2u←X̃1A1g transition is derived. An approximate (but accurate) form of this rule based on skeletal mode displacements is used to obtain absorptivity values for C6H6 1410 (6.3×10-50 cm4 s mol-1 photon-1) and 1510 (1.6×10-50 cm4 s mol-1 photon-1) from the measured absorptivity ratio, δ↑↑(15)/δ↑↑(14) and from the measured value of 1401. We also report the sum-rule-predicted hot and cold band absolute absorptivities in the other D6h benzenes, C6D6, 13C6H6 and 13C6D6. © 1990.
引用
收藏
页码:253 / 259
页数:7
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