Matthew Witman1, Sanliang Ling2, Peter Boyd3, Senja Barthel3, Maciej Haranczyk4, Ben Slater2 and Berend Smit1,3, (1)Department of Chemical and Biomolecular Engineering, University of California, Berkeley, Berkeley, CA, (2)Department of Chemistry, University College London, London, United Kingdom, (3)Institut des Sciences et Ingénierie Chimiques (ISIC), Valais, École Polytechnique Fédérale de Lausanne (EPFL), Sion, Switzerland, (4)Computational Research Division, Lawrence Berkeley National Laboratory, Berkeley, CA