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Monday, September 17, 2012
Accurate Ab Initio-Based Force Field for Predictive CO2 Uptake Simulations in MOFs and ZIFs: Development and Applications for MTV-MOFs
Sang Soo Han, Daejin Kim, Dong Hyun Jung, Sangyeon Cho, Seung-Hoon Choi and Yousung Jung
The Journal of Physical Chemistry C
DOI: 10.1021/jp307865n
Link to full article
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