Modeling breathing of Mil-53: from force fields to thermodynamic insights

L. Vanduyfhuys, T. Verstraelen, A. Ghysels, S. Vandenbrande, R. Demuynck, S.M.J. Rogge, R. Schmid, G. Maurin, M. Waroquier, V. Van Speybroeck

ISBN/ISSN:

Poster

Conference / event / venue

Flexibility and disorder in Metal-Organic Frameworks

Paris, France

Wednesday, 3 June, 2015 to Friday, 5 June, 2015