Reactive molecular dynamics simulations of hydration shells surrounding spherical TiO 2 nanoparticles: implications for proton-transfer reactions

Summary

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Authors: Federico A. Soria, Cristiana Di Valentin

Journal title: Nanoscale

Journal number: 13/7

Journal publisher: Royal Society of Chemistry

Published year: 2021

Published pages: 4151-4166

DOI identifier: 10.1039/d0nr07503e

ISSN: 2040-3364