【作者单位】1 Department of Physics, Taiyuan Normal University, Jinzhong, 030619, China 2 Institute of Computational and Applied Physics, Taiyuan Normal University, Jinzhong, 030619, China
【年份】2022
【卷号】Vol.342
【ISSN】0038-1098
【关键词】Ab initio C15-Laves phase Mg2Ce Lattice dynamics Mechanical stability
【摘要】 A systematic study of the structure, mechanical properties, lattice dynamics and thermo-physical properties of C15-Laves phase Mg 2 Ce is performed through density functional theory and density functional perturbation theory . The optimized equilibr...
