DiSCaMB

DiSCaMB is a C++ library for calculation of structure factors from the Hansen-Coppens multipolar model of crystal electron density featuring parallel implementation for multicore processors and graphic processing units.

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Download documentation DiSCaMB_doc
Source code authors: Michal Chodkiewicz & Szymon Migacz

People involved in the project: Michał L. Chodkiewicz, Szymon Migacz, Witold Rudnicki, Anna Makala, Nigel W. Moriarty, Ralf W. Grosse-Kunstleve, Pavel Afonine, Jarosław Kalinowski, Paul D. Adams, Paulina M. Dominiak