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Hydration mechanism of molybdenite affected by surface oxidation: New insights from DFT and MD simulations

Wenfeng Pan, Shulei Li, Yangge Zhu, Lihui Gao, Zilong Ma, Yijun Cao, Shijie Du

2024Colloids and Surfaces A Physicochemical and Engineering Aspects14 citationsDOI

Topics & Concepts

MolybdeniteMechanism (biology)Materials scienceChemistryChemical physicsComputational chemistryMetallurgyPhysicsQuantum mechanicsFluid inclusionsQuartzIron oxide chemistry and applicationsMinerals Flotation and Separation TechniquesClay minerals and soil interactions
Hydration mechanism of molybdenite affected by surface oxidation: New insights from DFT and MD simulations | Litcius