{"type":"journal_article","citation":{"apa":"Kapil, V., Rossi, M., Marsalek, O., Petraglia, R., Litman, Y., Spura, T., … Ceriotti, M. (2018). i-PI 2.0: A universal force engine for advanced molecular simulations. Computer Physics Communications, 214–223. https://doi.org/10.1016/j.cpc.2018.09.020","chicago":"Kapil, Venkat, Mariana Rossi, Ondrej Marsalek, Riccardo Petraglia, Yair Litman, Thomas Spura, Bingqing Cheng, et al. “I-PI 2.0: A Universal Force Engine for Advanced Molecular Simulations.” Computer Physics Communications, 2018, 214–23. https://doi.org/10.1016/j.cpc.2018.09.020.","mla":"Kapil, Venkat, et al. “I-PI 2.0: A Universal Force Engine for Advanced Molecular Simulations.” Computer Physics Communications, 2018, pp. 214–23, doi:10.1016/j.cpc.2018.09.020.","ieee":"V. Kapil et al., “i-PI 2.0: A universal force engine for advanced molecular simulations,” Computer Physics Communications, pp. 214–223, 2018.","bibtex":"@article{Kapil_Rossi_Marsalek_Petraglia_Litman_Spura_Cheng_Cuzzocrea_Meißner_Wilkins_et al._2018, title={i-PI 2.0: A universal force engine for advanced molecular simulations}, DOI={10.1016/j.cpc.2018.09.020}, journal={Computer Physics Communications}, author={Kapil, Venkat and Rossi, Mariana and Marsalek, Ondrej and Petraglia, Riccardo and Litman, Yair and Spura, Thomas and Cheng, Bingqing and Cuzzocrea, Alice and Meißner, Robert H. and Wilkins, David M. and et al.}, year={2018}, pages={214–223} }","ama":"Kapil V, Rossi M, Marsalek O, et al. i-PI 2.0: A universal force engine for advanced molecular simulations. Computer Physics Communications. 2018:214-223. doi:10.1016/j.cpc.2018.09.020","short":"V. Kapil, M. Rossi, O. Marsalek, R. Petraglia, Y. Litman, T. Spura, B. Cheng, A. Cuzzocrea, R.H. Meißner, D.M. Wilkins, B.A. Helfrecht, P. Juda, S.P. Bienvenue, W. Fang, J. Kessler, I. Poltavsky, S. Vandenbrande, J. Wieme, C. Corminboeuf, T.D. Kühne, D.E. Manolopoulos, T.E. Markland, J.O. Richardson, A. Tkatchenko, G.A. Tribello, V. Van Speybroeck, M. Ceriotti, Computer Physics Communications (2018) 214–223."},"user_id":"65425","publication_identifier":{"issn":["0010-4655"]},"year":"2018","author":[{"full_name":"Kapil, Venkat","last_name":"Kapil","first_name":"Venkat"},{"first_name":"Mariana","last_name":"Rossi","full_name":"Rossi, Mariana"},{"first_name":"Ondrej","full_name":"Marsalek, Ondrej","last_name":"Marsalek"},{"first_name":"Riccardo","full_name":"Petraglia, Riccardo","last_name":"Petraglia"},{"last_name":"Litman","full_name":"Litman, Yair","first_name":"Yair"},{"full_name":"Spura, Thomas","last_name":"Spura","first_name":"Thomas"},{"first_name":"Bingqing","last_name":"Cheng","full_name":"Cheng, Bingqing"},{"last_name":"Cuzzocrea","full_name":"Cuzzocrea, Alice","first_name":"Alice"},{"last_name":"Meißner","full_name":"Meißner, Robert H.","first_name":"Robert H."},{"full_name":"Wilkins, David M.","last_name":"Wilkins","first_name":"David M."},{"full_name":"Helfrecht, Benjamin A.","last_name":"Helfrecht","first_name":"Benjamin A."},{"full_name":"Juda, Przemysław","last_name":"Juda","first_name":"Przemysław"},{"full_name":"Bienvenue, Sébastien P.","last_name":"Bienvenue","first_name":"Sébastien P."},{"last_name":"Fang","full_name":"Fang, Wei","first_name":"Wei"},{"last_name":"Kessler","full_name":"Kessler, Jan","first_name":"Jan"},{"full_name":"Poltavsky, Igor","last_name":"Poltavsky","first_name":"Igor"},{"full_name":"Vandenbrande, Steven","last_name":"Vandenbrande","first_name":"Steven"},{"first_name":"Jelle","full_name":"Wieme, Jelle","last_name":"Wieme"},{"first_name":"Clemence","full_name":"Corminboeuf, Clemence","last_name":"Corminboeuf"},{"first_name":"Thomas D.","last_name":"Kühne","full_name":"Kühne, Thomas D."},{"last_name":"Manolopoulos","full_name":"Manolopoulos, David E.","first_name":"David E."},{"first_name":"Thomas E.","full_name":"Markland, Thomas E.","last_name":"Markland"},{"last_name":"Richardson","full_name":"Richardson, Jeremy O.","first_name":"Jeremy O."},{"first_name":"Alexandre","full_name":"Tkatchenko, Alexandre","last_name":"Tkatchenko"},{"full_name":"Tribello, Gareth A.","last_name":"Tribello","first_name":"Gareth A."},{"first_name":"Veronique","last_name":"Van Speybroeck","full_name":"Van Speybroeck, Veronique"},{"full_name":"Ceriotti, Michele","last_name":"Ceriotti","first_name":"Michele"}],"publication_status":"published","doi":"10.1016/j.cpc.2018.09.020","date_created":"2021-09-01T09:03:51Z","status":"public","_id":"23597","publication":"Computer Physics Communications","title":"i-PI 2.0: A universal force engine for advanced molecular simulations","date_updated":"2022-01-06T06:55:57Z","language":[{"iso":"eng"}],"page":"214-223"}