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首页> 外文期刊>Romanian journal of physics >SPECTRAL AND THERMODYNAMIC PROPERTIES OF CHOLESTERYL MYRISTATE IN THE REGION OF PHASE TRANSITION*
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SPECTRAL AND THERMODYNAMIC PROPERTIES OF CHOLESTERYL MYRISTATE IN THE REGION OF PHASE TRANSITION*

机译:相变区中十二烷基硫酸盐的光谱和热力学性质*

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摘要

In this article we report on temperature dependence of Davydov splitting value FTIR spectra study for the in-phase CH_2 rocking vibrations of methylene chains in liquid crystalline cholesteryl myristate (CholC_(14)) for the temperature region from 100 K to the crystal melting point. A statistic-dynamic model in terms of stochastic equations is used to explain the obtained results. We take into account the damping of vibrational excitons on orientational defects due to excitation of conformational, librational and position disorder degrees of freedom. The explicit expression for the theoretical dependence of Davydov splitting value of vibrational exitones on temperature was considered. Good agreement between the experimental data and the results of such dependence computer simulation is observed.
机译:在这篇文章中,我们报道了在从100 K到晶体熔点的温度范围内,液晶肉豆蔻酸酯(CholC_(14))中亚甲基链的CH_2同相CH_2摇摆振动的Davydov分裂值FTIR光谱研究的温度依赖性。使用基于随机方程的统计动态模型来解释所获得的结果。由于构象,自由和位置无序度的激发,我们考虑了振动激子在取向缺陷上的阻尼。考虑了振动排出口的戴维多夫分裂值与温度的理论关系的明确表达。观察到实验数据与这种依赖计算机模拟的结果之间的良好一致性。

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