First-principles calculations of the structural, mechanical, electronic and bonding properties of (CrB 2 ) n CrAl with n = 1, 2, 3

标题
First-principles calculations of the structural, mechanical, electronic and bonding properties of (CrB 2 ) n CrAl with n = 1, 2, 3
作者
关键词
Electronic structure, Mechanical properties, Band crossing, (CrB, 2, ), n, CrAl, First-principles calculations
出版物
JOURNAL OF ALLOYS AND COMPOUNDS
Volume 698, Issue -, Pages 291-303
出版商
Elsevier BV
发表日期
2016-12-18
DOI
10.1016/j.jallcom.2016.12.219

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