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Simple Quantum Dynamics with Thermalization
[Image: see text] In this paper, we introduce two simple quantum dynamics methods. One is based on the popular surface-hopping method, and the other is based on rescaling of the propagation on the bath ground-state potential surface. The first method is special, as it avoids specific feedback from t...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical
Society
2017
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5770886/ https://www.ncbi.nlm.nih.gov/pubmed/29199829 http://dx.doi.org/10.1021/acs.jpca.7b10380 |