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Unraveling Interactions in Molecular Crystals Using Dispersion Corrected Density Functional Theory: The Case of the Epoxydihydroarsanthrene Molecules
Otero-de-la-Roza, A., Luaña, Víctor, Tiekink, Edward R. T., Zukerman-Schpector, JulioVolume:
10
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct500832g
Date:
November, 2014
File:
PDF, 2.25 MB
english, 2014