i-PI 2.0: A universal force engine for advanced molecular simulations.

Venkat Kapil Mariana Rossi Ondrej Marsalek Riccardo Petraglia Yair Litman Thomas Spura Bingqing Cheng Alice Cuzzocrea Robert H. Meißner David M. Wilkins Benjamin A. Helfrecht Przemyslaw Juda Sébastien P. Bienvenue Wei Fang Jan Kessler Igor Poltavsky Steven Vandenbrande Jelle Wieme Michele Ceriotti

Published in: Comput. Phys. Commun. (2019)

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