Round Robin Study: Molecular Simulation of Thermodynamic Properties from Models with Internal Degrees of Freedom

Schappals, Michael; Mecklenfeld, Andreas; Kröger, Leif Christian; Botan, Vitalie; Köster, Andreas; Stephan, Simon; García, Edder J.; Rutkai, Gabor; Raabe, Gabriele; Klein, Peter; Leonhard, Kai; Glass, Colin W.; Lenhard, Johannes; Vrabec, Jadran; Hasse, Hans (Corresponding author)

Washington, DC : American Chemical Society (2017)
Journal Article

In: Journal of chemical theory and computation : JCTC
Volume: 13
Issue: 9
Page(s)/Article-Nr.: 4270-4280