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

Autor: Chizhik, Vladimir I., Egorov, Andrei V., Pavlova, Maria S., Egorova, Maria I., Donets, Aleksey V.
Zdroj: In Journal of Molecular Liquids December 2016 224 Part A:730-736
Databáze: ScienceDirect