Unraveling the Temperature Effects on the Raman Spectra of V <sub>2</sub> O <sub>5</sub> by Combining Machine Learning and Molecular Dynamics
but also establishes an effective computational framework for interpreting Raman spectra recorded under realistic conditions, such as those of catalysts in operation.
Authors
- Annette Trunschke (ORCID: https://orcid.org/0000-0003-2869-0181)
- Runhai Ouyang (ORCID: https://orcid.org/0000-0001-9020-0484)
- H. Pan (ORCID: https://orcid.org/0009-0008-7741-7169)
Institutions
- Shanghai University (CN)
- Tongji University (CN)
- Fritz Haber Institute of the Max Planck Society (DE)
Publication Details
- Journal
- The Journal of Physical Chemistry Letters
- Published
- 2026-04-07
- DOI
- https://doi.org/10.1021/acs.jpclett.6c00632
- Primary Topic
- Catalysis and Oxidation Reactions
- Type
- article
- Field-Weighted Citation Impact
- 0.00
Funders
- National Natural Science Foundation of China