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Elastic and thermodynamical properties of cubic (3C) silicon carbide under high pressure and high temperature
2015
Journal of Theoretical and Applied Physics
Pressure-dependent first-order phase transition, mechanical, elastic, and thermodynamical properties of cubic zinc blende to rock-salt structures in 3C silicon carbide (SiC) are presented. An effective interatomic interaction potential for SiC is formulated. The potential for SiC incorporates long-range Coulomb, charge transfer interactions, covalency effect, Hafemeister and Flygare type short-range overlap repulsion extended up to the second-neighbour ions, van der Waals interactions and zero
doi:10.1007/s40094-015-0183-7
fatcat:engfmaaqg5frlcs7brlzgnbhtq