Search Results for author: Jack S. Baker

Found 1 papers, 1 papers with code

Grad DFT: a software library for machine learning enhanced density functional theory

1 code implementation23 Sep 2023 Pablo A. M. Casares, Jack S. Baker, Matija Medvidovic, Roberto dos Reis, Juan Miguel Arrazola

Density functional theory (DFT) stands as a cornerstone method in computational quantum chemistry and materials science due to its remarkable versatility and scalability.

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