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Shahsavari R, Pellenq RJean-Marc, Ulm F-J.  2010.  Empirical force fields for complex hydrated calcio-silicate layered materials. Phys. Chem. Chem. Phys.. 13(3):1002-1011.
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Qomi M J A, Krakowiak KJ, Bauchy M, Stewart K.L., Shahsavari R, Jagannathan D., Brommer D.B., Baronnet A, Buehler MJ, Yip S et al..  2014.  Combinatorial molecular optimization of cement hydrates. Nat Commun. 5:ArticleNumber:4960.