Montero de Hijes, C

· 2024 · DOI 10.1063/5.0227514

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Can DFT-trained neural network potentials reproduce structure, solvation, and water-exchange properties in aqueous magnesium solutions?

physics.chem-ph · 2026-06-18

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Can DFT-trained neural network potentials reproduce structure, solvation, and water-exchange properties in aqueous magnesium solutions? physics.chem-ph · 2026-06-18 · unreviewed · ref 55