Rahbari, A. (author), Hens, R. (author), Nikolaidis, I.K. (author), Poursaeidesfahani, A. (author), Ramdin, M. (author), Economou, I. G. (author), Moultos, O. (author), Dubbeldam, D. (author), Vlugt, T.J.H. (author) An alternative method for calculating partial molar excess enthalpies and partial molar volumes of components in Monte Carlo (MC) simulations is developed. This method combines the original idea of Frenkel, Ciccotti, and co-workers with the recent continuous fractional component Monte Carlo (CFCMC) technique. The method is tested for a system...
journal article 2018
