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Determination of partial molar volumes from free energy perturbation theory()

Partial molar volume is an important thermodynamic property that gives insights into molecular size and intermolecular interactions in solution. Theoretical frameworks for determining the partial molar volume (V°) of a solvated molecule generally apply Scaled Particle Theory or Kirkwood–Buff theory....

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Bibliografski detalji
Izdano u:Phys Chem Chem Phys
Glavni autori: Vilseck, Jonah Z., Tirado-Rives, Julian, Jorgensen, William L.
Format: Artigo
Jezik:Inglês
Izdano: 2015
Teme:
Online pristup:https://ncbi.nlm.nih.gov/pmc/articles/PMC4872387/
https://ncbi.nlm.nih.gov/pubmed/25589343
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c4cp05304d
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