Ab initio calculations of elastic properties and electronic structure of L12-Co3(Al,W) under pressure

被引:0
|
作者
Yao, Chuansheng [1 ]
Chen, Zheng [1 ]
Du, Xiujuan [1 ]
机构
[1] State Key Laboratory of Solidification Processing, Northwestern Polytechnical University, Xi'an,710072, China
关键词
Ab initio calculations - Clean systems - Elastic properties - L12-Co3(Al; W) compound - Nearest neighbors - Pressure dependent - Pseudopotentials - Zero pressure;
D O I
暂无
中图分类号
学科分类号
摘要
引用
收藏
页码:457 / 462
相关论文
共 50 条
  • [21] Ab initio calculations of structural, elastic, and electronic properties of silver nitrides
    A. B. Gordienko
    Yu. N. Zhuravlev
    Journal of Structural Chemistry, 2010, 51 : 401 - 408
  • [22] Ab initio calculations of structural, elastic, and electronic properties of silver nitrides
    Gordienko, A. B.
    Zhuravlev, Yu. N.
    JOURNAL OF STRUCTURAL CHEMISTRY, 2010, 51 (03) : 401 - 408
  • [23] Ab initio calculations of some electronic and elastic properties for SiC polytypes
    Konstantinova, E.
    Bell, M. J. V.
    Anjos, V.
    INTERMETALLICS, 2008, 16 (08) : 1040 - 1042
  • [24] Structural, elastic, vibrational and electronic properties of amorphous Al2O3 from ab initio calculations
    Davis, Sergio
    Gutierrez, Gonzalo
    JOURNAL OF PHYSICS-CONDENSED MATTER, 2011, 23 (49)
  • [25] First principles calculations of structural, elastic, electronic properties of Ir3Zr with L12 structure under high pressure
    Liu, Na
    Wang, Xueye
    Wan, Yali
    MATERIALS CHEMISTRY AND PHYSICS, 2015, 162 : 807 - 812
  • [26] Ab initio study of structural, elastic, and electronic properties of Mo3.46B12 under high pressure
    Leon-Flores, J.
    Romero, M.
    Rosas, J. L.
    Escamilla, R.
    EUROPEAN PHYSICAL JOURNAL B, 2019, 92 (02):
  • [27] Ab initio study of structural, elastic, and electronic properties of Mo3.46B12 under high pressure
    J. León-Flores
    M. Romero
    J. L. Rosas
    R. Escamilla
    The European Physical Journal B, 2019, 92
  • [28] Ab initio calculations of the structural, electronic and elastic properties of K3CrF6
    Gruia, A. S.
    Avram, C. N.
    Avram, N. M.
    Brik, M. G.
    PHYSICA SCRIPTA, 2012, T149
  • [29] Elastic properties and electronic structures of L12 Co3(Ge,W)
    Yao, Q.
    Wang, Y.
    Zhu, Y. H.
    PHYSICA B-CONDENSED MATTER, 2010, 405 (12) : 2753 - 2756
  • [30] Electronic structure and optical properties of α-Fe-Al alloy from ab initio calculations
    Adebambo, P. O.
    Bamgbose, K. M.
    Olowofela, J. A.
    Oguntuase, J. A.
    Adebayo, G. A.
    PHYSICA B-CONDENSED MATTER, 2010, 405 (21) : 4578 - 4581