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Hydration shell structures in a LiI solution at elevated temperature and pressure: a molecular dynamics study |
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| Authors: | Gyula I Szász Karl Heinzinger |
| Institution: | Max-Planck-Institut für Chemie (Otto-Hahn-Institut), Mainz, F.R.G. |
| Abstract: | Molecular dynamics simulations of a 0.55 molal aqueous LiI solution have been performed at 508 K and 308 K and a density of 1.05 g/cm3. The structural changes resulting from increased temperature and pressure are discussed. |
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