Information
Official site
License
GPL v2
Availability | Confirmed compilation environment: Confirmed compilation environment for multithreaded calculation (Compatible with multithreaded calculation using OPENMP): |
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Core Developers | Atsuto Seko (Graduate School of Enginnering, Kyoto University) |
Target substance/model | Atsuto Seko (Graduate School of Enginnering, Kyoto University) |
Physical quantities that can be computed | Ground state structure, thermodynamic quantity, and equilibrium state diagram |
Methodology | Thermodynamic calculation using cluster expansion method |
Parallelization | Parallel computing by OpenMP is supported. |
Related App | |
Document | A. Seko, Y. Koyama and I. Tanaka, Phys. Rev. B 80, 165122 (2009). |