V. Vesovic et al., QUANTUM-MECHANICAL CALCULATION OF GENERALIZED COLLISION CROSS-SECTIONS FOR THE HE-N-2 INTERACTION .2. THERMOMAGNETIC EFFECT, Molecular physics, 84(3), 1995, pp. 553-576
For the He-N-2 system quantum mechanical calculations of the generaliz
ed cross-sections that govern thermal conductivity and the thermomagne
tic effect in mixtures have been performed. The results provide a set
of 'benchmark' cross-sections for atom-heavy rigid rotor systems inter
acting through a realistic anisotropic intermolecular potential. In ad
dition, comparisons have been made with equivalent calculations using
the classical trajectory approach. The results indicate that the more
rapid classical trajectory calculations yield results of an acceptable
accuracy for all of the important generalized cross-sections.