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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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Bibliografiset tiedot
Julkaisussa:Phys Chem Chem Phys
Päätekijät: Vilseck, Jonah Z., Tirado-Rives, Julian, Jorgensen, William L.
Aineistotyyppi: Artigo
Kieli:Inglês
Julkaistu: 2015
Aiheet:
Linkit: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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