Comparison of the Site Occupancies Determined by Combined Rietveld Refinement and Density Functional Theory Calculations: Example of the Ternary Mo–Ni–Re σ Phase

Title
Comparison of the Site Occupancies Determined by Combined Rietveld Refinement and Density Functional Theory Calculations: Example of the Ternary Mo–Ni–Re σ Phase
Authors
Keywords
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Journal
INORGANIC CHEMISTRY
Volume 51, Issue 5, Pages 3071-3078
Publisher
American Chemical Society (ACS)
Online
2012-02-23
DOI
10.1021/ic202479y

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