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researcher

M. Barbatti

11 papers hereh-index 5310.5k citations251 works total

Matching runs newest-first, so older work may not be attached to this profile yet.

author position
  • middle author7
  • last author4

Across the 11 of 11 papers where every author was matched, so the position is known.

fields
  • physics.chem-ph8
  • cs.LG1
  • physics.comp-ph1
  • quant-ph1

identity via Semantic Scholar / OpenAlex

activity
20222026
most citedMLatom 3: Platform for machine learning-enhanced computational chemistry simulations and workflows

70 citations · 171 across the 11 of their papers we have counts for

collaborators
Showing 2025 · physics.comp-phShow all

1 paper · 2 filters

physics.comp-ph2025★ 10 cited

A Descriptor Is All You Need: Accurate Machine Learning of Nonadiabatic Coupling Vectors

Jakub Martinka, Lina Zhang, Yi-Fan Hou +4

Nonadiabatic couplings (NACs) play a crucial role in modeling photochemical and photophysical processes with methods such as the widely used fewest-switches surface hopping (FSSH).…

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Not affiliated with arXiv. Researcher data from Semantic Scholar (ODC-BY) and OpenAlex.