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Site-renormalised molecular fluid theory: on the utility of a two-site model of water
We propose a simple, two-site model of water, using the familiar three-site Simple Point Charge (SPC) model as a guide. We briefly examine the resulting dielectric and solvation properties of the bulk fluid, both pure and in a three component mixture of apolar or ionic simple fluid solutes, using in...
Tallennettuna:
| Päätekijät: | , , , |
|---|---|
| Aineistotyyppi: | Artigo |
| Kieli: | Inglês |
| Julkaistu: |
2009
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| Aiheet: | |
| Linkit: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2777734/ https://ncbi.nlm.nih.gov/pubmed/19920881 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1080/00268970902845313 |
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