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首页> 外文期刊>Journal of Quantitative Spectroscopy & Radiative Transfer >Vibrational shifts of absorption bands of linear molecules diluted in high-density rare gases: Measurements and modeling for CO2-Rg and OCS-Rg
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Vibrational shifts of absorption bands of linear molecules diluted in high-density rare gases: Measurements and modeling for CO2-Rg and OCS-Rg

机译:高密度稀有气体稀释的线性分子吸收带的振动变化:CO2-RG和OCS-RG的测量和建模

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摘要

Increase of buffer gas pressure causes redistribution of intensity in the IR absorption bands and, indicating the presence of vibrational perturbation, changes the first spectral moment value responsible for the band-origin position. Band-origin shift coefficients for the v(3) , 2v(3) and v(2) bands of OCS and the v(3) band of CO2 diluted in high-density Ar, Kr and Xe are measured and calculated by two methods: directly with available in the literature vibrationally dependent potential-energy surfaces for both initial and final vibrational states and assuming that vibrational dependence arises from the interaction of the permanent /transient dipole moment of the absorbing molecule and the dipole moment induced on the perturber. A comparative analysis of results is given, showing a general underestimation of calculations with respect to measurements. (C) 2020 Elsevier Ltd. All rights reserved.
机译:缓冲气体压力的增加导致IR吸收带中的强度的再分布,并且表明存在振动扰动的存在,改变负责的带原点位置的第一光谱力矩值。 测量在高密度AR,KR和XE中稀释的OC的V(3),2V(3)和V(2)条带的V(3),2V(3)和V(2)带的带原因移位系数,并通过两种方法计算并计算 :直接在文献中可用的振动依赖性潜在 - 能量表面,用于初始和最终振动状态,并且假设振动依赖性产生了吸收分子的永久性/瞬时偶极矩的相互作用和在Perturber上诱导的偶极力矩。 给出了结果的比较分析,表明关于测量值的计算一般性低估。 (c)2020 elestvier有限公司保留所有权利。

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