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Published in 2021 at "Applied Surface Science"
DOI: 10.1016/j.apsusc.2021.150269
Abstract: Abstract By using density functional theory (DFT), the potential of two dimensional SiC, SiC with Stone-Wales defect (SW-SiC) and their van der Waals heterostructures with graphene (SiC/graphene and SW-SiC/graphene) as anode materials have been investigated,…
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Keywords:
van der;
der waals;
graphene sic;
graphene ... See more keywords
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Published in 2023 at "RSC Advances"
DOI: 10.1039/d2ra07365j
Abstract: This research unravels the photocatalytic properties of a 2D ZnO/SiC van der Waals hetero-bilayer for potential water-splitting applications by first-principles calculations. Four unique stacking patterns are considered in studying the electronic and optical properties in…
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Keywords:
photocatalytic properties;
water splitting;
zno sic;
sic van ... See more keywords