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Simulating Quantum Vibronic Dynamics at Finite Temperatures With Many Body Wave Functions at 0 K
For complex molecules, nuclear degrees of freedom can act as an environment for the electronic “system” variables, allowing the theory and concepts of open quantum systems to be applied. However, when molecular system-environment interactions are non-perturbative and non-Markovian, numerical simulat...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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Frontiers Media S.A.
2021
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7831969/ https://www.ncbi.nlm.nih.gov/pubmed/33505954 http://dx.doi.org/10.3389/fchem.2020.600731 |