Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
Charting electronic-state manifolds across molecules with multi-state learning and gap-driven dynamics via efficient and robust active learning
, Authors:
Mikołaj Martyka, Lina Zhang, Fuchun Ge, Yi-Fan Hou, Joanna Jankowska, Mario Barbatti, Pavlo O. Dral
Version 1 posted 06 August 2024
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