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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 101, 2003 - Issue 15
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Original Articles

Thermal diffusion in binary mixtures containing molecular gases II: mixtures of N2 with He, Ne, Ar, and Kr and of CO2 with He and Ar

Pages 2409-2426 | Received 20 Nov 2002, Accepted 20 Mar 2003, Published online: 18 Nov 2009
 

Abstract

Expressions developed for the thermal diffusion factor, αT, for binary mixtures containing molecular species have been tested for six different atom-molecule interactions. Specifically, the interactions between N2 and He, Ne, Ar and Kr, plus the interactions between CO2 and He, Ar, have been examined, in each case using at least two competing modern potential energy surfaces. Detailed expressions in both the ‘total-energy-flux’ and the ‘two-flux’ representations have been developed, and the importance of the anisotropic components of the intermolecular potential energy surfaces in determining the thermal diffusion factor for such mixtures has been determined.

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