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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...

詳細記述

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書誌詳細
主要な著者: Aghtar, Mortaza, Liebers, Jörg, Strümpfer, Johan, Schulten, Klaus, Kleinekathöfer, Ulrich
フォーマット: Artigo
言語:Inglês
出版事項: American Institute of Physics 2012
主題:
オンライン・アクセス: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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