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QuickFF: toward a generally applicable methodology to quickly derive accurate force fields for Metal-Organic Frameworks from ab initio input

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L. Vanduyfhuys, S. Vandenbrande, T. Verstraelen, R. Schmid, M. Waroquier, V. Van Speybroeck

Journal of Computational Chemistry

2015

A1

Published while none of the authors were employed at the CMM

DOI

http://dx.doi.org/

Postscript First

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Preface First

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Preface Third

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