H-H-2 collision integrals and transport coefficients

被引:37
作者
Stallcop, JR [1 ]
Partridge, H [1 ]
Levin, E [1 ]
机构
[1] NASA,AMES RES CTR,THERMOSCI INST,MOFFETT FIELD,CA 94035
关键词
D O I
10.1016/0009-2614(96)00285-0
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 transport cross sections and collision integrals for H-H-2 interactions have been calculated from the results of accurate ab initio structure calculations using sudden scattering approximations. The low-temperature diffusion and viscosity coefficients agree well with the results of a close-coupling scattering calculation. The values calculated from the potential energies deduced from scattering measurements are in agreement with the theoretical results. The viscosity coefficients for H-H and H-2-H-2 have also been calculated; the H-2-H-2 results are very close to the measured data for temperatures in the range 200-400 K.
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页码:25 / 31
页数:7
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