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Multiscale reactive molecular dynamics
Many processes important to chemistry, materials science, and biology cannot be described without considering electronic and nuclear-level dynamics and their coupling to slower, cooperative motions of the system. These inherently multiscale problems require computationally efficient and accurate met...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Institute of Physics
2012
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3432097/ https://ncbi.nlm.nih.gov/pubmed/23249062 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4743958 |
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