Investigation of structural and Kinetic Properties by the Simulation of Molecular Dynamics

Abaturov, R.; Gontcharenko, E. A.; Zilberman, V. P.; Znamenskiy, Vasiliy

Advances in Molten Salts

ISBN Druckformat: 1-56700-142-4

Investigation of structural and Kinetic Properties by the Simulation of Molecular Dynamics

Purchase PDF $35.00

R. Abaturov Kabardino-Balkarian State University, Nalchik, KBR, Russia

E. A. Gontcharenko Kabardino-Balkarian State University, Nalchik, KBR, Russia

V. P. Zilberman Kabardino-Balkarian State University, Nalchik, KBR, Russia

Vasiliy Znamenskiy BMCC, CUNY

Abstrakt

Molecular-dynamics calculations have been performed on different ionic crystal systems based on the Group 1 halides, using Pauling and Bom-Huggins-Mayer rigid potentials. Results formixed crystals are presented. The significance of the structural dynamic characteristics is discussed, including the temperature dependence and the mechanics of formation of melts in the initial stages.

Begell Recommend

Electrospinning of Micro- and Nanofibers: Fundamentals in Separation and Filtration Processes Y. Filatov
A. Budyka
V. Kirichenko ISBN Druckformat: 978-1-56700-241-6
ISBN Online: 978-1-56700-240-9

Thermal Radiation in Disperse Systems: An Engineering Approach Leonid Dombrovsky
Dominique Baillis ISBN Druckformat: 978-1-567000-268-3
ISBN Online: 978-1-56700-351-2