A molecular dynamics study of liquid aliphatic alcohols: simulation of density and self-diffusion coefficient using a modified OPLS force field

Author: Kulschewski Tobias   Pleiss Jürgen  

Publisher: Taylor & Francis Ltd

ISSN: 0892-7022

Source: Molecular Simulation, Vol.39, Iss.9, 2013-08, pp. : 754-767

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Abstract