TY - JOUR AU - Eric Cockayne C2 - Journal of Physical Chemistry Letters DA - 2017-02-06 DO - https://doi.org/10.1021/acs.jpcc.6b11692 LA - en PB - Journal of Physical Chemistry Letters PY - 2017 TI - Thermodynamics of the Flexible Metal-Organic Framework Material MIL-53(Cr) From First Principles ER -