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Modeling hydroxylated nanosilica: Testing the performance of ReaxFF and FFSiOH force fields

Research areaChemistry and Materials Science and Technology
TitleModeling hydroxylated nanosilica: Testing the performance of ReaxFF and FFSiOH force fields
Publication TypeJournal Article
Publication year2017
AuthorsEscatllar, AMacia, Ugliengo, P, Bromley, ST
JournalJournal of Chemical Physics
Volume146
Number22
DOI10.1063/1.4985083