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      Advances in Clayff Molecular Simulation of Layered and Nanoporous Materials and Their Aqueous Interfaces

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          Comparison of simple potential functions for simulating liquid water

          William L Jorgensen, Jayaraman Chandrasekhar, Jeffry Madura … (1983)
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            Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids

            William L Jorgensen, David Maxwell, Julian Tirado-Rives (1996)
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              The missing term in effective pair potentials

              H. J. C. Berendsen, J. Grigera, T Straatsma (1987)
              Article 0 comments Cited 842 times – based on 0 reviews     Review now
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                Author and article information

                Contributors
                Randall T. Cygan: (View ORCID Profile)
                Jeffery A. Greathouse: (View ORCID Profile)
                Andrey G. Kalinichev: (View ORCID Profile)
                Journal
                Title: The Journal of Physical Chemistry C
                Abbreviated Title: J. Phys. Chem. C
                Publisher: American Chemical Society (ACS)
                ISSN (Print): 1932-7447
                ISSN (Electronic): 1932-7455
                Publication date Created: August 19 2021
                Publication date (Electronic): July 22 2021
                Publication date (Print): August 19 2021
                Volume: 125
                Issue: 32
                Pages: 17573-17589
                Affiliations
                [1 ]Geochemistry Department, Sandia National Laboratories, Albuquerque, New Mexico 87185-0754, United States
                [2 ]Laboratoire SUBATECH (UMR 6457 − Institut Mines-Télécom Atlantique, Université de Nantes, CNRS/IN2P3), 44307, Nantes, France
                Article
                DOI: 10.1021/acs.jpcc.1c04600
                SO-VID: 0675d67d-50b6-48d5-9c21-b8e897fd097a
                Copyright © © 2021
                License:

                https://doi.org/10.15223/policy-029

                https://doi.org/10.15223/policy-037

                https://doi.org/10.15223/policy-045

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