Na-Montmorillonite Edge Structure and Surface Complexes: An Atomistic Perspective
نویسندگان
چکیده
منابع مشابه
Acidity of edge surface sites of montmorillonite and kaolinite
Acid–base chemistry of clay minerals is central to their interfacial properties, but up to now a quantitative understanding on the surface acidity is still lacking. In this study, with first principles molecular dynamics (FPMD) based vertical energy gap technique, we calculate the acidity constants of surface groups on (010)-type edges of montmorillonite and kaolinite, which are representatives...
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ژورنال
عنوان ژورنال: Minerals
سال: 2017
ISSN: 2075-163X
DOI: 10.3390/min7050078