Synthesis and ab initio calculations of nanolaminated (Cr,Mn)2AlC compounds

被引:101
作者
Mockute, Aurelija [1 ]
Dahlqvist, Martin [1 ]
Emmerlich, Jens [2 ]
Hultman, Lars [1 ]
Schneider, Jochen M. [2 ]
Persson, Per O. A. [1 ]
Rosen, Johanna [1 ]
机构
[1] Linkoping Univ, Dept Phys Chem & Biol IFM, SE-58183 Linkoping, Sweden
[2] Rhein Westfal TH Aachen, D-52074 Aachen, Germany
基金
欧洲研究理事会; 瑞典研究理事会;
关键词
M(N+1)AX(N) PHASES; TI;
D O I
10.1103/PhysRevB.87.094113
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We present an ab initio theoretical analysis of the temperature-dependent stability of inherently nanolaminated (Cr1-xMnx)(2)AlC. The results indicate energetic stability over the composition range x = 0.0 to 0.5 for temperatures >= 600 K. Corresponding thin film compounds were grown by magnetron sputtering from four elemental targets. X-ray diffraction in combination with analytical transmission electron microscopy, including electron energy-loss spectroscopy and energy dispersive x-ray spectroscopy analysis, revealed that the films were epitaxial (0001)-oriented single-crystals with x up to 0.16. DOI: 10.1103/PhysRevB.87.094113
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页数:4
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