Blar i SINTEF Open på forfatter "Müller, Erich A."
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Equation of state and force fields for Feynman–Hibbs-corrected Mie fluids. I.Application to pure helium, neon, hydrogen, and deuterium
Aasen, Ailo; Hammer, Morten; Ervik, Åsmund; Müller, Erich A.; Wilhelmsen, Øivind (Journal article; Peer reviewed, 2019)We present a perturbation theory that combines the use of a third-order Barker–Henderson expansion of the Helmholtz energy with Miepotentials that include first- (Mie-FH1) and second-order (Mie-FH2) Feynman–Hibbs quantum ... -
A guide to computing interfacial properties of fluids from molecular simulations
Müller, Erich A.; Ervik, Åsmund; Mejìa, Andrès (Peer reviewed; Journal article, 2021)Molecular simulation is ideally suited to explore and describe the behavior of inhomogeneous fluid mixtures as it allows a unique perspective into the physics at the scale relevant to interfacial properties, filling the ... -
Prediction of the water/oil interfacial tension from molecular simulations using the coarse-grained SAFT-γ Mie force field
Herdes, Carmelo; Ervik, Åsmund; Mejìa, Andrès; Müller, Erich A. (Journal article; Peer reviewed, 2017)This work is framed within the Ninth Industrial Fluid Properties Simulation Challenge, with the aim of assessing the capability of molecular simulation methods and force fields to accurately predict the interfacial tension ...