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Predicting structural properties of fluids by thermodynamic extrapolation
We describe a methodology for extrapolating the structural properties of multicomponent fluids from one thermodynamic state to another. These properties generally include features of a system that may be computed from an individual configuration such as radial distribution functions, cluster size di...
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| Pubblicato in: | J Chem Phys |
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| Autori principali: | , , , , |
| Natura: | Artigo |
| Lingua: | Inglês |
| Pubblicazione: |
2018
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| Soggetti: | |
| Accesso online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6183068/ https://ncbi.nlm.nih.gov/pubmed/30307179 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.5026493 |
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