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Chemistry of Materials : a Publication of the American Chemical Society|September 9, 2020
Computational Investigation of Copper Phosphides as Conversion Anodes for Lithium-Ion BatteriesAngela F Harper, Matthew L Evans, Andrew J MorrisJournal of Physics. Condensed Matter : an Institute of Physics Journal|July 8, 2021
Robust model benchmarking and bias-imbalance in data-driven materials science: a case study on MODNetPierre-Paul De Breuck, Matthew L Evans, Gian-Marco RignaneseFaraday Discussions|September 19, 2024
Optical materials discovery and design with federated databases and machine learningVictor Trinquet, Matthew L Evans, Cameron J Hargreaves, et al.Chemistry of Materials : a Publication of the American Chemical Society|August 29, 2022
Phase Transformations and Phase Segregation during Potassiation of Sn <i></i> P <i></i> AnodesAndrew W Ells, Matthew L Evans, Matthias F Groh, et al.Digital Discovery|June 4, 2026
<i>optimade-maker</i>: automated generation of interoperable materials APIs from static datasetsKristjan Eimre, Matthew L Evans, Bud Macaulay, et al.Journal of the American Chemical Society|November 21, 2023
Machine Learning-Accelerated Discovery of <i>A</i><sub>2</sub><i>BC</i><sub>2</sub> Ternary Electrides with Diverse Anionic Electron DensitiesZhiqi Wang, Yutong Gong, Matthew L Evans, et al.Journal of the American Chemical Society|June 20, 2018
Sodiation and Desodiation via Helical Phosphorus Intermediates in High-Capacity Anodes for Sodium-Ion BatteriesLauren E Marbella, Matthew L Evans, Matthias F Groh, et al.Chemical Society Reviews|April 25, 2025
Cross-disciplinary perspectives on the potential for artificial intelligence across chemistryAustin M Mroz, Annabel R Basford, Friedrich Hastedt, et al.Machine Learning: Science and Technology|October 6, 2025
32 examples of LLM applications in materials science and chemistry: towards automation, assistants, agents, and accelerated scientific discoveryYoel Zimmermann, Adib Bazgir, Alexander Al-Feghali, et al.Scientific Data|August 13, 2021
OPTIMADE, an API for exchanging materials dataCasper W Andersen, Rickard Armiento, Evgeny Blokhin, et al.Pageof 2