Hydration mechanisms of smithsonite from DFT-D calculations and MD simulations
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Title
Hydration mechanisms of smithsonite from DFT-D calculations and MD simulations
Authors
Keywords
H, 2, O, Smithsonite surface, DFT, MD, Coverage rate
Journal
International Journal of Mining Science and Technology
Volume -, Issue -, Pages -
Publisher
Elsevier BV
Online
2022-02-10
DOI
10.1016/j.ijmst.2022.01.009
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