【作者单位】1School of Materials Science and Engineering, Yancheng Institute of Technology, Yancheng 224051, China 2College of Materials Science and Engineering, Nanjing Tech University, Nanjing 210009, China 3Department of Physics, Taiyuan Normal University, Taiyuan 030031, China
【摘要】 The structural parameters, electronic structures, and mechanical and thermodynamic properties of TaSi under different pressures have been completely explored by a combination of density functional theory and quasi-harmonic Debye model. Results show t...
