Effective fragment potential method in Q-CHEM: A guide for users and developers

Debashree Ghosh, Dmytro Kosenkov, Vitalii Vanovschi, Joanna Flick, Ilya Kaliman, Yihan Shao, Andrew T. B. Gilbert, Anna I. Krylov, Lyudmila V. Slipchenko. Effective fragment potential method in Q-CHEM: A guide for users and developers. Journal of Computational Chemistry, 34(12):1060-1070, 2013. [doi]

Abstract

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