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Broadening of Vibrational-Rotational Lines of the H_2S Molecule by Pressure of Monatomic Gases

机译:单原子气体压力对H_2S分子振动-旋转线的拓宽

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摘要

Optimal sets of parameters for a model intermolecular potential that provide the best reproduction of broadening coefficients γ for the absorption lines in the v_2 band of the H_2S molecule are determined for systems H_2S-A (A = He, Ne, Ar, Kr, and Xe). For H_2S-He, the potential is obtained with the temperature dependence of coefficients γ taken into account for two rotational absorption lines 1_(10) ← 1_(01) and 2_(11) ← 2_(02). With the potentials obtained, the coefficients γ are calculated for the v_1 and v_3 bands and compared with the available experimental data. There are significant discrepancies between the calculated and experimental values of γ.
机译:对于系统H_2S-A(A = He,Ne,Ar,Kr和Xe),确定了模型分子间电势的最佳参数集,这些参数为H_2S分子的v_2带中的吸收线提供了最佳的扩宽系数γ再现)。对于H_2S-He,在考虑到两个旋转吸收线1_(10)←1_(01)和2_(11)←2_(02)时系数γ的温度依赖性下获得电势。利用获得的电势,针对v_1和v_3频段计算系数γ,并将其与可用的实验数据进行比较。 γ的计算值与实验值之间存在显着差异。

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