IR NU-S(XH) ABSORPTION-BAND SHAPE OF H-BONDED COMPLEX IN CONDENSED MEDIA .2. NUMERICAL-CALCULATIONS OF THE PROFILES

被引:31
作者
ABRAMCZYK, H
机构
[1] Technical University, Institute of Applied Radiation Chemistry, 93-590 Lodz
关键词
D O I
10.1016/0301-0104(90)80097-H
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 IR absorption band profiles of H-bonded complexes in the spectral range 600-3600 cm-1 have been calculated in terms of the theory presented in the accompanying paper. We have considered the IR band profiles as a function of strength of the H-bond, the influence of the environment on the band shape and the effect of fluctuations of the energy potential well, in which the vibrational transition of the νs(XH) mode occurs. © 1990.
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页码:319 / 326
页数:8
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