TY - RPRT TI - Quantitatively Predicting Impact of Structural Flexibility on Molecular Diffusion in Small Pore Metal–Organic Frameworks—A Molecular Dynamics Study of Hypothetical ZIF-8 Polymorphs AU - Han, Chu AU - Yang, Yuhan AU - Sholl, David S. PY - 2020 DO - 10.1021/acs.jpcc.0c05942 UR - https://www.osti.gov/biblio/1802412 ID - 1802412 ER -