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.
Download DiSCaMB
Download documentation DiSCaMB_doc
Source code authors: Michal Chodkiewicz & Szymon Migacz
Contact: mchodkiewicz@chem.uw.edu.pl
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