Information
Last Update:2021/03/06

Official site

http://www.tcm.phy.cam.ac.uk/~mdt26/casino2.html

License

A written agreement is required before use (source code will be provided). Free for academic use (paid use for commercial use)
AvailabilityLanguage: FORTRAN90 Operating environment: K supercomputer, CRAY-XT5, SGI-altix-UV, Hitachi SR11000, Linux clusters, etc.
Core Developershttps://vallico.net/casinoqmc/people/
Target substance/modelAll real substances (solids and molecular systems) that can be subject to first-principles calculation.
Physical quantities that can be computedElectron state, ground state energy, pair correlation function, density matrix, structural factor, and spin density
MethodologyElectron state calculation using quantum Monte Carlo method
ParallelizationParallel computing by MPI and OpenMP is supported. High-efficient operation by parallel computing using flat-MPI up to 530,000 nodes has been checked. http://www.jaist.ac.jp/is/labs/maezono-lab/wiki/index.php A version supporting GPGPU parallel computing exists, but has not been released. J. Comput. Chem. 34, 83 (2013). J. Comput. Chem. 32, 2264 (2011).
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