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Browsing by Author Piaggi, Pablo M

Showing results 1 to 5 of 5
Publication DateArticle TitleAuthor(s)
29-Apr-2021Enhancing the formation of ionic defects to study the ice Ih/XI transition with molecular dynamics simulationsPiaggi, Pablo M; Car, Roberto
11-Aug-2022Homogeneous ice nucleation in an ab initio machine-learning model of waterPiaggi, Pablo M; Weis, Jack; Panagiotopoulos, Athanassios Z; Debenedetti, Pablo G; Car, Roberto
4-Aug-2022Phase diagram of the TIP4P/Ice water model by enhanced sampling simulationsBore, Sigbjørn L; Piaggi, Pablo M; Car, Roberto; Paesani, Francesco
27-May-2020Phase equilibrium of liquid water and hexagonal ice from enhanced sampling molecular dynamics simulationsPiaggi, Pablo M; Car, Roberto
9-Apr-2021Phase Equilibrium of Water with Hexagonal and Cubic Ice Using the SCAN FunctionalPiaggi, Pablo M; Panagiotopoulos, Athanassios Z; Debenedetti, Pablo G; Car, Roberto