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Number of items: 3.

2013

Calero, Carles and Martí, Jordi and Guàrdia, Elvira and Masia, Marco (2013) Characterization of the methane–graphene hydrophobic interaction in aqueous solution from ab initio simulations. Journal of Chemical Theory and Computation, Vol. 9 (11), p. 5070-5075. ISSN 1549-9618. eISSN 1549-9626. Article.

2011

Kumar Rana, Malay and Pazzona, Federico Giovanni and Suffritti, Giuseppe Baldovino and Demontis, Pierfranco and Masia, Marco (2011) Estimation of partial charges in small zeolite imidazolate frameworks from density functional theory calculations. Journal of Chemical Theory and Computation, Vol. 7 (6), p. 1575-1582. ISSN 1549-9618. eISSN 1549-9626. Article.

2009

Guàrdia, Elvira and Skarmoutsos, Ioannis and Masia, Marco (2009) On ion and molecular polarization of halides in water. Journal of Chemical Theory and Computation, Vol. 5 (6), p. 1449-1453. eISSN 1549-9626. Article.

This list was generated on Sun Nov 23 03:32:12 2014 CET.