GPU accelerated implementation of NCI calculations using promolecular density - researchr publication authors

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Gaëtan Rubez, Jean-Matthieu Etancelin, Xavier Vigouroux, Michaël Krajecki, Jean-Charles Boisson, Eric Henon. GPU accelerated implementation of NCI calculations using promolecular density. Journal of Computational Chemistry, 38(14):1071-1083, 2017. [doi]

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