Structure of hydration shell of calcium cation by NMR relaxation, Car-Parrinello molecular dynamics and quantum-chemical calculations

Published 2016 View Full Article

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Title
Structure of hydration shell of calcium cation by NMR relaxation, Car-Parrinello molecular dynamics and quantum-chemical calculations
Authors
Keywords
Hydration shells, Calcium cation, NMR relaxation, Car-Parrinello molecular dynamics, Quantum-chemical calculations
Journal
JOURNAL OF MOLECULAR LIQUIDS
Volume 224, Issue -, Pages 730-736
Publisher
Elsevier BV
Online
2016-10-12
DOI
10.1016/j.molliq.2016.10.035

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