Acidity Constants of the Hematite-Liquid Water Interface from ab-initio Molecular Dynamics

Journal: The Journal of Physical Chemistry Letters

Published: 2018-09-04

DOI: 10.1021/acs.jpclett.8b01870

Affiliations: 3

Authors: 4

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Institutions FC
Thomas Young Centre (TYC) - The London Centre for the Theory and Simulation of Materials, United Kingdom (UK) 0.50
UCL Department of Chemistry, United Kingdom (UK) 0.25
Physical Sciences Division (PSD), PNNL, United States of America (USA) 0.25