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Browsing by Subject "Hybrid density functional theory"

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Insights into the photocatalytic mechanism of mediator-free direct Z-scheme g-C3N4/Bi2MoO6(010) and g-C3N4/Bi2WO6(010) heterostructures: A hybrid density functional theory study

Author: Opoku, F ; Govender, Krishna ; Van Sittert, CGCE ; Govender, PP Date: Jan 2018 Graphite-like carbon nitride (g-C3N4)-based heterostructures have received much attention due to their prominent photocatalytic activity. The g-C3N4/Bi2WO6 and g-C3N4/Bi2MoO6 heterostructures, which follow a typical hetero-junction charge ... Read more

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Browsing by Subject "Hybrid density functional theory"

Browsing by Subject "Hybrid density functional theory"

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