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Simulation from the first principal theory on the effect of supporting silica on graphene and the new composite material

Author: Kiarii, EM ; Govender, Krishna ; Ndungu, PG ; Govender, PP Date: Jul 2017 Silica has been used as support material with many photocatalytic materials. In this study, silica polymorphs on graphene and epoxy graphene were studied using Density Functional Theory (DFT) to determine the interfacial and optical properties ... Read more

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Browsing by Subject "Density functional theories"

Browsing by Subject "Density functional theories"

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