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DFT Studies on the Effects of C Vacancy on the CO2 Capture Mechanism of Silicon Carbide Nanotubes Photocatalyst (Si12C12-X; X = 1; 2)

Yahaya Saadu Itas, Razif Razali, Salisu Tata, Mohammed Kolo, Abdullahi Lawal, Sharif Abu Alrub, J. El Ghoul, Mayeen Uddin Khandaker

2023Silicon17 citationsDOI

Topics & Concepts

OverpotentialMaterials scienceDensity functional theoryVacancy defectBand gapAbsorption (acoustics)Absorption spectroscopySilicon carbideCarbon nanotubeCarbidePhysical chemistryComputational chemistryNanotechnologyCondensed matter physicsOptoelectronicsPhysicsOpticsChemistryElectrochemistryMetallurgyComposite materialElectrodeBoron and Carbon Nanomaterials ResearchAdvanced ceramic materials synthesisZnO doping and properties
DFT Studies on the Effects of C Vacancy on the CO2 Capture Mechanism of Silicon Carbide Nanotubes Photocatalyst (Si12C12-X; X = 1; 2) | Litcius