Lunger, Jaclyn R.
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Year of Publication:2023
Atom-by-atom design of metal oxide catalysts for the oxygen evolution reaction with machine learning
arXiv:2305.19930,2023
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Year of Publication:2021
Crystal graph convolutional neural networks for per-site property prediction
Fourth Workshop on Machine Learning and the Physical Sciences at NeurIPS,2021
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Year of Publication:2023
Machine-learning-accelerated simulations enable heuristic-free surface reconstruction
arXiv:2305.07251,2023
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Year of Publication:2023
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Year of Publication:2022
Human- and machine-centred designs of molecules and materials for sustainability and decarbonization
Nature Reviews Materials,2022