Transport and relaxation properties of isotopomeric hydrogen-helium binary mixtures.: II.: HD, D2, T2-He mixtures

被引:7
作者
McCourt, FRW [1 ]
Weir, D
Thachuk, M
Clark, GB
机构
[1] Univ Waterloo, Dept Chem, Waterloo, ON N2L 3G1, Canada
[2] Univ British Columbia, Dept Chem, Vancouver, BC V6T 1Z1, Canada
[3] Univ Toronto, Dept Biochem, Toronto, ON M5S 1A8, Canada
基金
加拿大自然科学与工程研究理事会;
关键词
D O I
10.1080/00268970412331292722
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 comprehensive comparison between calculated bulk non-equilibrium properties of hydrogen-helium isotopomeric mixtures and experiment that has previously been carried out for H-2-helium mixtures [2004, Molec. Phys., submitted] has been extended to mixtures of HD, D-2 and T-2 with He-3 and He-4. For HD-He-4 mixtures, comparison is also made, where possible, with previous calculations of Kohler and Schaefer [1983, Physica A, 120, 185]. The phenomena examined herein include low temperature interaction second virial coefficients, binary diffusion and thermal conductivity coefficients, rotational relaxation, transport property field effects and flow birefringence. Scattering calculations have been carried out for the HD-He PES of Schaefer and Kohler [1985, Physica A, 129, 469], and for both the Kohler-Schaefer and Tao [1994, J. chem. Phys., 100, 4947] potential surfaces for the D-2-He and T-2-He interactions. Comparisons between calculated and experimental results for HD, D-2, T-2-He mixtures confirm the conclusion, reached earlier from the H-2-He comparisons, that these potential surfaces are very close to the correct one for the hydrogen-helium interaction, and that the small differences between them cannot be distinguished readily by measurements of bulk gas phenomena unless the attendant experimental uncertainties are better than +/-0.3%.
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页码:45 / 58
页数:14
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