We simulated all solids and liquids using 5 ns Langevin dynamics simulations. ASA, α-methanol, and argon were simulated respectively at 298.15 K, 150.0 K, and 4.0 K. Our simulations had the same length as the simulations run by Aragonès et al. All solid state simulations were run in NVT conditions. Liquid state simulations were run in NPT conditions; pressure was kept constant at 101.335 kPa using the Parrinello-Rahman barostat . We used the TIP3P water model for all our liquid state simulations. More simulation details and example input files with full details can be found in the Supporting Information.