PiNNwall: Heterogeneous Electrode Models from Integrating Machine Learning and Atomistic Simulation

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Authors: Thomas Dufils, Lisanne Knijff, Yunqi Shao, and Chao Zhang

Journal title: Journal of Chemical Theory and Computation

Journal number: 19/15

Journal publisher: American Chemical Society

Published year: 2023

DOI identifier: 10.1021/acs.jctc.3c00359

ISSN: 1549-9618