Fick diffusion coefficients of binary fluid mixtures consisting of methane, carbon dioxide, and propane via molecular dynamics simulations based on simplified pair-specific ab initio-derived force fields (2019) Higgoda U, Hewa Kankanamge CJK, Hellmann R, Koller TM, Fröba AP Journal article, Original article Enhancement of the predictive power of molecular dynamics simulations for the determination of self-diffusion coefficient and viscosity demonstrated for propane (2019) Higgoda U, Hellmann R, Koller TM, Fröba AP Journal article, Original article Self-diffusion coefficient and viscosity of methane and carbon dioxide via molecular dynamics simulations based on new ab initio-derived force fields (2019) Higgoda U, Hellmann R, Koller TM, Fröba AP Journal article, Original article Stabilized density gradient theory algorithm for modeling interfacial properties of pure and mixed systems (2017) Mu X, Frank F, Alpak FO, Chapman WG Journal article, Original article Probability density distribution in the prediction of reaction equilibria (2017) Westermeyer M, Müller K Journal article, Original article The seventh industrial fluid properties simulation challenge. (2014) Ross RB, Ahmad R, Brennan JK, Frankel KA, Moore JD, Moore JD, Mountain RD, et al. Journal article, Original article Perfluorohexane adsorption in BCR-704 Faujasite zeolite benchmark studies for the seventh industrial fluid properties simulation challenge. (2014) Ross RB, Brennan JK, Frankel KA, Moore JD, Moore JD, Mountain RD, Ahmad R, et al. Journal article, Original article A Raman spectroscopic method for determining vapour liquid equilibria (2013) Adami R, Schuster J, Liparoti S, Reverchon E, Leipertz A, Bräuer A Journal article, Original article Prediction of phase equilibria in systems containing large flexible molecules using COSMO-RS: State-of-the-problem (2012) Mokrushina L, Yamin P, Sponsel E, Arlt W Journal article Equation of state for aqueous electrolyte systems based on the semirestricted non-primitive mean spherical approximation (2010) Herzog S, Gross J, Arlt W Journal article