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A first-principles study of half-Heusler intermetallic compound MgAgAs with 2D-TiC/2D-Mo2TiC composite material
Kiarii, EM
;
Govender, Krishna
;
Mamo, MA
;
Govender, PP
(
Springer
,
2018-10
)
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
)
DFT Study of Skutterudite CoSb3 and In0.2Co4Sb12 Thermoelectric Heterostructures with 2D-WSe2
Kiarii, EM
;
Govender, Krishna
;
Mamo, MA
;
Govender, PP
(
Wiley online library
,
2018-08
)
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
)
A DFT study of disperse yellow 119 degradation mechanism by hydroxyl radical attack
Wahab, OO
;
Olasunkanmi, LO
;
Govender, Krishna
;
Govender, PP
(
Wiley
,
2018-12
)
Tuning the electronic structures, work functions, optical property and stability of bifunctional hybrid graphene oxide/V–doped NaNbO3 type–II heterostructures: A promising photocatalyst for H2 production
Opoku, F
;
Govender, Krishna
;
Van Sittert, CGCE
;
Govender, PP
(
Elsevier
,
2018-09
)
Recent advances in titanium dioxide/graphene photocatalyst materials as potentials of energy generation
Kiarii, EM
;
Govender, Krishna
;
Ndungu, PG
;
Govender, PP
(
Indian Academy of Sciences
,
2018-06
)
DMol3/COSMO-RS prediction of aqueous solubility and reactivity of selected Azo dyes: Effect of global orbital cut-off and COSMO segment variation
Wahab, OO
;
Olasunkanmi, LO
;
Govender, Krishna
;
Govender, PP
(
Elsevier
,
2018-01
)
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Govender, Krishna (8)
Govender, PP (8)
Kiarii, EM (3)
Opoku, F (3)
Mamo, MA (2)
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Van Sittert, CGCE (2)
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Azo dye (2)
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Date Issued
2018 (8)
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