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Dynamics of electrically charged extended bodies: Classical and quantum systems

✍ Scribed by Terje Aaberge


Publisher
Springer
Year
1987
Tongue
English
Weight
366 KB
Volume
26
Category
Article
ISSN
0020-7748

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## Abstract Simulations using __ab initio__ quantum mechanical charge field molecular dynamics (QMCF MD) and classical molecular dynamics using two‐body and three‐body potentials were performed to investigate the hydration of the Ca^2+^ ion at different temperatures. Results from the simulations de