@misc{indiciae789d1e628892, title = {Multi-GPU RI-HF Energies and Analytic Gradients─Toward High-Throughput Ab Initio Molecular Dynamics}, author = {Stocks, Ryan (ORCID:0000000306549670) and Palethorpe, Elise (ORCID:0009000908147158) and Barca, Giuseppe}, year = {2024}, doi = {10.1021/acs.jctc.4c00877}, url = {https://www.osti.gov/biblio/2581497}, note = {Source identifier: 2581497} }