摘要
Theelectronicstructureof FeAlisdetermined byone cell state method andthepotentialenergy curve,lattice constant, cohesive energy, bulk elastic module, and the variation of linear thermalexpansion coefficient with temteraturearecalculated.
Theelectronicstructureof FeAlisdetermined byone cell state method andthepotentialenergy curve,lattice constant, cohesive energy, bulk elastic module, and the variation of linear thermalexpansion coefficient with temteraturearecalculated.
