Martensitic transformation and magnetism in Ni and Fe-rich compositions of Ni-Fe-Ga shape memory alloys

被引:8
作者
Chabungbam, Satyananda [1 ]
Borgohain, Parijat [1 ]
Ghosh, Subhradip [2 ]
Singh, Navdeep [3 ]
Sahariah, Munima B. [1 ]
机构
[1] Inst Adv Study Sci & Technol, Gauhati 781035, India
[2] Indian Inst Technol, Dept Phys, Gauhati 781039, India
[3] Univ Houston, Dept Engn Technol, Houston, TX 77204 USA
关键词
Ab-initio calculations; Magnetic shape memory alloys; Martensite transformation; Curie temperature; TOTAL-ENERGY CALCULATIONS; EXCHANGE INTERACTIONS; HEUSLER; NI2FEGA; PSEUDOPOTENTIALS; MICROSTRUCTURE; SUBSTITUTION; METALS;
D O I
10.1016/j.jallcom.2016.07.211
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
First principles spin polarized calculations have been performed to study the martensitic transformation and magnetism in stoichiometric and off-stoichiometric compositions of Ni-Fe-Ga shape memory alloys. The energy difference between cubic phase and non-modulated tetragonal phase has been estimated. The calculated shear elastic constants are found to have correlations with the valence electron concentration per atom (e/a value). From the analyses on local magnetic moments, it is observed that direct and indirect magnetic exchange occur in these alloys. The Curie temperatures estimated from the exchange parameters are found to be sensitive to the change in alloy composition. (C) 2016 Elsevier B. V. All rights reserved.
引用
收藏
页码:199 / 207
页数:9
相关论文
共 51 条
  • [1] Structural properties of magnetic Heusler alloys
    Ayuela, A
    Enkovaara, J
    Ullakko, K
    Nieminen, RM
    [J]. JOURNAL OF PHYSICS-CONDENSED MATTER, 1999, 11 (08) : 2017 - 2026
  • [2] Hot deformation behavior of Ni-Fe-Ga-based ferromagnetic shape memory alloy - A study using processing map
    Biswas, Aniruddha
    Singh, Gaurav
    Sarkar, Sudip Kumar
    Krishnan, Madangopal
    Ramamurty, Upadrasta
    [J]. INTERMETALLICS, 2014, 54 : 69 - 78
  • [3] First-principles and Monte Carlo study of magnetostructural transition and magnetocaloric properties of Ni2+xMn1-xGa
    Buchelnikov, V. D.
    Sokolovskiy, V. V.
    Herper, H. C.
    Ebert, H.
    Gruner, M. E.
    Taskaev, S. V.
    Khovaylo, V. V.
    Hucht, A.
    Dannenberg, A.
    Ogura, M.
    Akai, H.
    Acet, M.
    Entel, P.
    [J]. PHYSICAL REVIEW B, 2010, 81 (09):
  • [4] Elastocaloric and magnetocaloric effects in Ni-Mn-Sn(Cu) shape-memory alloy
    Castillo-Villa, Pedro O.
    Manosa, Lluis
    Planes, Antoni
    Soto-Parra, Daniel E.
    Sanchez-Llamazares, J. L.
    Flores-Zuniga, H.
    Frontera, Carlos
    [J]. JOURNAL OF APPLIED PHYSICS, 2013, 113 (05)
  • [5] Correlation between phonon anomaly along [211] and the Fermi surface nesting features with associated electron-phonon interactions in Ni2FeGa: A first principles study
    Chabungbam, Satyananda
    Sahariah, Munima B.
    [J]. JOURNAL OF ALLOYS AND COMPOUNDS, 2015, 647 : 70 - 74
  • [6] Martensitic phase transformation in single crystal Ni54Fe19Ga27
    Chen, P.
    Zhang, X. X.
    [J]. SOLID STATE COMMUNICATIONS, 2007, 143 (4-5) : 255 - 259
  • [7] Peculiarities of magnetoelastic coupling in Ni51.5Fe21.5Ga27 single crystals
    Corro, M. L.
    Chumlyakov, Y. I.
    Torrens-Serra, J.
    Kustov, S.
    [J]. JOURNAL OF PHYSICS D-APPLIED PHYSICS, 2013, 46 (37)
  • [8] Competing structural ordering tendencies in Heusler-type alloys with high Curie temperatures: Fe2CoGa1-xZnx studied by first-principles calculations
    Dannenberg, Antje
    Siewert, Mario
    Gruner, Markus E.
    Wuttig, Manfred
    Entel, Peter
    [J]. PHYSICAL REVIEW B, 2010, 82 (21)
  • [9] Magnetic Compton scattering study of the Co2FeGa Heusler alloy:: Experiment and theory -: art. no. 064409
    Deb, A
    Itou, M
    Sakurai, Y
    Hiraoka, N
    Sakai, N
    [J]. PHYSICAL REVIEW B, 2001, 63 (06)
  • [10] Martensitic transition and structural modulations in Ni51Fe24Ga25 ferromagnetic shape-memory alloy
    Du, Z. W.
    Shao, B. L.
    Liu, A. S.
    Wu, G. H.
    Qian, J. F.
    Zhang, Z. Y.
    Gao, Z.
    [J]. JOURNAL OF MATERIALS SCIENCE, 2011, 46 (08) : 2733 - 2740