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Structure, mechanical and phonon stability of the Th-Sn system from ab initio

  • 【作者】Jin-Wen Yang,Li An,Jing-Jing Zheng
  • 【刊名】Journal of Nuclear Materials
  • 【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】2021
  • 【卷号】Vol.556
  • 【页码】153187
  • 【ISSN】0022-3115
  • 【关键词】Th-Sn System Mechanical Properties Tension Shear Phonon Ab Initio 
  • 【摘要】 The first-principles projector augmented-wave method within the framework of density functional theory is applied to study the equilibrium lattice parameters, mechanical stability, tensile and shear properties, lattice dynamical stability and vibra...
  • 【文献类型】 期刊
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