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Understanding the synergistic effects, optical and electronic properties of ternary Fe/C/S-doped TiO2 anatase within the DFT 1 U approach
Opoku, F
;
Govender, Krishna
;
Van Sittert, CGCE
;
Govender, PP
(
Wiley
,
2017-09
)
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
Opoku, F
;
Govender, Krishna
;
Van Sittert, CGCE
;
Govender, PP
(
Elsevier
,
2018-01
)
Hybrid DFT study of MWCNT/Zr-doped SrTiO3 heterostructure: Hydrogen production, electronic properties and charge Carrier mediator role of Zr4+ ion
Opoku, F
;
Govender, Krishna
;
van Sittert, CGCE
;
Govender, PP
(
Elsevier
,
2018-12
)
Enhancing photocatalytic activity for hydrogen production and pollutant degradation by modifying tetragonal ZrO2 with monolayers slab surface of BiVO4, Ag3PO4, SrTiO3 and WO3: A first-principles study
Opoku, F
;
Govender, Krishna
;
Van Sittert, CGCE
;
Govender, PP
(
Elsevier
,
2017-10
)
Role of MoS2 and WS2 monolayers on photocatalytic hydrogen production and the pollutant degradation of monoclinic BiVO4: a first-principles study
Opoku, F
;
Govender, Krishna
;
van Sittert, CGCE
;
Govender, PP
(
Royal Society of Chemistry
,
2017-10
)
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