Phase transition, lattice dynamical and thermodynamic properties of yttrium antimonide with the rock salt structure under high pressure: first-principles investigations
【刊名】International Journal of High Pressure Research
【作者单位】Department of Physics, Taiyuan Normal University, Taiyuan, 030031, People's Republic of China
【年份】2014
【卷号】Vol.34 No.1
【页码】78-88
【ISSN】0895-7959
【关键词】dynamical first principles high pressure phase transition thermodynamic
【摘要】 We investigate the structural, electronic, first-order pressure-induced phase transition, lattice dynamical, and thermodynamic properties of yttrium antimonide (YSb) with the rock salt structure at high pressures and high temperatures using the proje...
