PMV for LiCl salt rises and water falls up to 6.7 M then reverses as three- and four-body ion clusters form; MD polyhedral partitioning of snapshots quantitatively matches the experimental curve while Raman and DFT detail water electrostriction.
Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy , volume =
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Beyond the Virial Expansion: Microscopic Origins of Partial Molar Volumes in LiCl Solutions
PMV for LiCl salt rises and water falls up to 6.7 M then reverses as three- and four-body ion clusters form; MD polyhedral partitioning of snapshots quantitatively matches the experimental curve while Raman and DFT detail water electrostriction.