Competition between cubic and tetragonal phases in all-d-metal Heusler alloys, X2−xMn1+xV (X = Pd, Ni, Pt, Ag, Au, Ir, Co; x = 1, 0): a new potential direction of the Heusler family

Competition between cubic and tetragonal phases in all-d-metal Heusler alloys, X2−xMn1+xV (X = Pd, Ni, Pt, Ag, Au, Ir, Co; x = 1, 0): a new potential direction of the Heusler family

In this work, a series of all-d-metal Heusler alloys, X2 − xMn1 + xV (X = Pd, Ni, Pt, Ag, Au, Ir, Co; x; = 1, 0), were predicted by first principles. The series can be roughly divided into two categories: XMn2V (Mn-rich type) and X2MnV (Mn-poor type). Using optimized structural analysis, it is shown...

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Bibliographic Details
Main Authors: Yilin Han, Mengxin Wu, Yu Feng, Zhenxiang Cheng, Tingting Lin, Tie Yang, Rabah Khenata, Xiaotian Wang
Format: Article
Language:English
Published: International Union of Crystallography 2019-05-01
Series:IUCrJ
Subjects:
all-d-metal Heusler alloys
tetragonal deformation
computational modelling
density functional theory
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2052252519004007

Internet

http://scripts.iucr.org/cgi-bin/paper?S2052252519004007

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