NANOSYSTEMS: PHYSICS, CHEMISTRY, MATHEMATICS, 2012, 3 (6), P. 64–69
INTERATOMIC INTERACTION IN BBC METALS
V.E. Zalizniak – Siberian Federal University, Krasnoyarsk, Russia, Associate Professor, PhD, vzalizniak@sfu-kras.ru
Parameters of interatomic potential for 10 bcc metals are presented in this paper. The potential is based on the embedded atom method (V.E. Zalizniak, O.A. Zolotov. Universal interatomic potential for pure metals. Nanosystems: Physics, Chemistry, Mathematics 2012, v. 3(1), p.76). Parameters are determined empirically by fitting to the equilibrium lattice constant, sublimation energy, vacancy formation energy and elastic constants.
Keywords: interatomic potential, embedded atom method.
UDC 539.186.3
PACS 34.20.Cf
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