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Juxtaposing density matrix and classical path-based wave packet dynamics
In many physical, chemical, and biological systems energy and charge transfer processes are of utmost importance. To determine the influence of the environment on these transport processes, equilibrium molecular dynamics simulations become more and more popular. From these simulations, one usually d...
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| Hauptverfasser: | , , , , |
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| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
American Institute of Physics
2012
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| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3376871/ https://ncbi.nlm.nih.gov/pubmed/22697524 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4723669 |
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