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Nonadiabatic dynamics in multidimensional complex potential energy surfaces
Despite the continuous development of theoretical methodologies for describing nonadiabatic dynamics of molecular systems, there is a lack of approaches for processes where the norm of the wave function is not conserved, i.e., when an imaginary potential accounts for some irreversible decaying mecha...
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| Gepubliceerd in: | Chem Sci |
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| Hoofdauteurs: | , |
| Formaat: | Artigo |
| Taal: | Inglês |
| Gepubliceerd in: |
The Royal Society of Chemistry
2020
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| Onderwerpen: | |
| Online toegang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC8162122/ https://ncbi.nlm.nih.gov/pubmed/34094243 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/d0sc04197a |
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