Supporting Data for “Correlated Anion-Disorder in Heteroanionic Cubic TiOF₂”

Author: Benjamin J. Morgan
ORCID: 0000-0002-3056-8233

This is the Supporting Dataset for the manuscript “Correlated Anion-Disorder in Heteroanionic Cubic TiOF₂”

The dataset comprises three sections:

DFT and cluster expansion calculations performed to study O/F disorder in TiOF₂. (directory)
Scripts and raw numerical data for all figures included in the main manuscript and the Supporting Information (directory)
Additional Supporting Data. (directory)

Name		Name	Last commit message	Last commit date
Latest commit History 67 Commits
figure_plotting		figure_plotting
structure_prediction_dataset		structure_prediction_dataset
supporting_data		supporting_data
.gitignore		.gitignore
LICENSE		LICENSE
LICENSE_code		LICENSE_code
LICENSE_data		LICENSE_data
README.md		README.md

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Supporting Data for “Correlated Anion-Disorder in Heteroanionic Cubic TiOF₂”