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item_2585777.pdf (Preprint), 6MB
Curtis, F., Li, X., Rose, T., Vázquez-Mayagoitia, Á., Bhattacharya, S., Ghiringhelli, L. M., et al. (2018). GAtor: A First-Principles Genetic Algorithm for Molecular Crystal Structure Prediction. Journal of Chemical Theory and Computation, 14(4), 2246-2264. doi:10.1021/acs.jctc.7b01152.