Bulg. J. Phys. vol.27 no.2 (2000), pp. 054-057

Intermolecular Potentials and Thermophysical Properties of Large Globular Molecules

L. Zarkova1, U. Hohm2, P. Pirgov1
1Institute of Electronics, BAS, 72 Tzarigradsko shosse, 114 Sofia, Bulgaria
2Institut für Physikalische und Theoretische Chemic der Technischen Universität Braunschweig, Hans-Sommer-Strasse 10, D-38106 Braunschweig, Germany
Abstract. The goal of this work is to prove the applicability of the isotropic temperature-dependent potential (ITDP) to some polyatomic globular molecules and to obtain reliable data for their transport and equilibrium properties. The four parameters of this effective Lennard-Jones type potential are determined by minimization of the weighted sum of squared deviations between experimental and calculated viscosity and second virial coefficient data.

Full-text: PDF

go back