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Computer Simulation of Ion Cluster Speciation in Concentrated Aqueous Solutions at Ambient Conditions
Dynamic simulations are used to investigate ion cluster formation in unsaturated aqueous NaCl at 25 °C. Statistical, structural, and dynamic properties are reported. An effort is made to identify general behaviors that are expected to hold beyond the limitations of the force field. Above ~1 M, clust...
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| Natura: | Artigo |
| Lingua: | Inglês |
| Pubblicazione: |
2008
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| Accesso online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2561909/ https://ncbi.nlm.nih.gov/pubmed/18680338 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp801147t |
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