Efficient All-electron Hybrid Density Functionals for Atomistic Simulations Beyond 10,000 Atoms

Fuente: arXiv
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Bibliographic Details
Main Authors: Kokott, Sebastian, Merz, Florian, Yao, Yi, Carbogno, Christian, Rossi, Mariana, Havu, Ville, Rampp, Markus, Scheffler, Matthias, Blum, Volker
Format: Preprint
Published: 2024
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