DFT simulation of S-species interaction with smithsonite (0 0 1) surface: Effect of water molecule adsorption position
Surface sulfidization is the key to achieving good flotation performance of smithsonite, but its reaction mechanism at the atomic level remains poorly understood. In this work, the interaction of two S-species, i.e., S2− and SH− with smithsonite (0 0 1) surface in presence of water molecule was inve...
Main Authors: | , , , , , |
---|---|
Format: | Article |
Language: | English |
Published: |
Elsevier
2019-12-01
|
Series: | Results in Physics |
Online Access: | http://www.sciencedirect.com/science/article/pii/S2211379719315967 |