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Vibrational subsystem analysis: A method for probing free energies and correlations in the harmonic limit
A new vibrational subsystem analysis (VSA) method is presented for coupling global motion to a local subsystem while including the inertial effects of the environment. The premise of the VSA method is a partitioning of a system into a smaller region of interest and a usually larger part referred to...
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| Main Authors: | , , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
American Institute of Physics
2008
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| Assuntos: | |
| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2676147/ https://ncbi.nlm.nih.gov/pubmed/19063546 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.3013558 |
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