Data repository for "Mechanistic insight on water dissociation on pristine low-index TiO$_2$ surfaces from machine learning molecular dynamics simulations"

Zeng, Zezhu; Wodaczek, Felix; Liu, Keyang; Stein, Frederick; Hutter, Jürg; Chen, Ji; Cheng, Bingqing

Publications Repository - Helmholtz-Zentrum Dresden-Rossendorf

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Data repository for "Mechanistic insight on water dissociation on pristine low-index TiO$_2$ surfaces from machine learning molecular dynamics simulations"

Zeng, Z.; Wodaczek, F.; Liu, K.; Stein, F.; Hutter, J.; Chen, J.; Cheng, B.

This repository contains all input files and the thereby generated raw data used to generate figures and other results described in the corresponding paper.

Related publications

DOI: 10.1038/s41467-023-41865-8 references this (Id 38347) publication
Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces …
ROBIS: 38335 has used this (Id 38347) publication of HZDR-primary research data

Reseach data in external data repository
Publication year 2023
License: other (open)
Hosted on ZENODO: Link to location
DOI: 10.5281/zenodo.8301965

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Permalink: https://www.hzdr.de/publications/Publ-38347