The source code of the Bayesian optimization of photocatalysts research project.
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Updated
Oct 18, 2024 - Jupyter Notebook
The source code of the Bayesian optimization of photocatalysts research project.
Reproducible manuscript containing all data and code behind J. Phys. Chem. C 2020, 124, 11 6395–6404
Small database of band gaps and band energies for semiconductors commonly encountered in the PEC field
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