Efficient stochastic generation of special quasirandom structures

Journal Article · Tue Jan 01 00:00:00 EST 2013 · CALPHAD (Computer Coupling of Phase Diagrams and Thermochemistry)

DOI:https://doi.org/10.1016/j.calphad.2013.06.006· OSTI ID:1093130

van de walle, Axel ^[1]; Tiwary, Pratyush ^[1]; De Jong, Maarteen ^[2]; Olmsted, David ^[2]; Asta, Mark ^[2]; Dick, Alexey ^[3]; Shin, Dongwon ^[4]; Wang, Yi ^[5]; Chen, Long-Qing ^[5]; Liu, Zi-Kui ^[5]

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1. Brown University
2. University of California, Berkeley
3. Belarusian Institute of System Analysis
4. ORNL
5. Pennsylvania State University

• Research Organization: Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)
• Sponsoring Organization: Work for Others (WFO)
• DOE Contract Number: DE-AC05-00OR22725
• OSTI ID: 1093130
• Journal Information: CALPHAD (Computer Coupling of Phase Diagrams and Thermochemistry), Vol. 42; ISSN 0364-5916
• Country of Publication: United States
• Language: English