Ab initio simulation of excited-state potential energy surfaces with transferable deep quantum Monte Carlo

Zeno Schätzle, P. Bernát Szabó, Alice Cuzzocrea, Matěj Mezera, Frank Noé

Open source

DOI
10.1038/s43588-026-01065-y
Published
2026-11-06
Container
Nature Computational Science
Publisher
Springer Science and Business Media LLC
Open access
unknown

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BibTeX

@article{allodium:10.1038/s43588-026-01065-y,
  title = {Ab initio simulation of excited-state potential energy surfaces with transferable deep quantum Monte Carlo},
  author = {Zeno Schätzle and P. Bernát Szabó and Alice Cuzzocrea and Matěj Mezera and Frank Noé},
  year = {2026},
  journal = {Nature Computational Science},
  doi = {10.1038/s43588-026-01065-y},
  url = {https://doi.org/10.1038/s43588-026-01065-y}
}

RIS

TY  - JOUR
TI  - Ab initio simulation of excited-state potential energy surfaces with transferable deep quantum Monte Carlo
AU  - Zeno Schätzle
AU  - P. Bernát Szabó
AU  - Alice Cuzzocrea
AU  - Matěj Mezera
AU  - Frank Noé
PY  - 2026
JO  - Nature Computational Science
DO  - 10.1038/s43588-026-01065-y
UR  - https://doi.org/10.1038/s43588-026-01065-y
ER  - 

APA

Schätzle, Z., Szabó, P. B., Cuzzocrea, A., Mezera, M., & Noé, F. (2026). Ab initio simulation of excited-state potential energy surfaces with transferable deep quantum Monte Carlo. Nature Computational Science. https://doi.org/10.1038/s43588-026-01065-y

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