Structural, mechanical, electronic and optical properties of N-decorated single-walled silicon carbide nanotube photocatalyst for hydrogen evolution via water splitting …

YS Itas, R Razali, S Tata, M Kolo, H Osman… - … and Technology of …, 2023 - Taylor & Francis
This work investigates the fundamental photocatalytic properties of nitrogen-doped single-
walled silicon carbide nanotubes (N-doped SWSiCNTs) for hydrogen evolution for the first …

Investigation on radiation shielding potentials of barium calcium aluminosilicate glass material using silicon carbide nanotubes reinforcement

YS Itas, MD Albaqami, S Mohammad… - Radiation Physics and …, 2024 - Elsevier
This work investigated the gamma ray attenuation power of barium calcium aluminosilicate
glass by using silicon carbide nanotube modifiers. Shielding efficiency of BaO–15CaO …

New trends in gamma ray shielding features of silicate tellurite glass using cerium oxide nanoparticles reinforcement (xCeO2-20SiO2-(80-x) TeO2);(x= 10, 15, 20 and …

YS Itas, R Haldhar, AM Alsuhaibani, MS Refat… - Optical Materials, 2024 - Elsevier
In this work, we investigated the gamma ray shielding features of xCeO 2-0.2 SiO 2-(80-x)
TeO 2 glass using DFT and phy-x/PSD approach. Optimization of the silicate-tellurite glass …

Envisaging the quantum capacitance in modified monolayer silicon carbide

YS Itas, AM Alsuhaibani, MS Refat, MR Alrahili - Applied Physics A, 2024 - Springer
Versatile properties of electric double layer supercapacitors such as high output power,
safety, high efficiency and durability have gained so much attention for use as energy …

Structural, mechanical, electronic and optical properties of Si decorated zinc oxide nanotube photocatalyst for hydrogen evolution via overall water splitting: A DFT …

YS Itas, R Razali, MU Khandaker, S Tata… - Physica B: Condensed …, 2024 - Elsevier
This work investigated an Si-doped single-walled zinc oxide nanotube (SWZnONT) as
photocatalyst for hydrogen energy production. Photocatalytic properties of the Si-doped …

DFT studies on structural, electronic and optical properties of aluminum nitride nanotube doped by different concentrations of boron

YS Itas, NH Alotaibi, S Mohammad, R Haldhar… - Materials Chemistry and …, 2024 - Elsevier
Nanotubes are an exceptional class of materials whose unusual properties depend on
geometry and composition. In this work, we have investigated the optoelectronic properties …

Radon adsorption by carboxyl, phosphate and amine functionalized hexagonal boron nitride as predicted by density functional theory: An approach to radiation …

IF Alshdoukhi, KM Al-Ahmary, SR Al-Mhyawi… - Diamond and Related …, 2025 - Elsevier
Radon is a colorless and radioactive noble gas, which can severely harm human health
during acute exposure. So, it is highly necessary to improve ways of capturing Rn gas for the …

DFT Studies of Photocatalytic Properties of Silicon-and Boron-doped Gallium-nitride Nanotubes for Hydrogen Evolution and Carbondioxide Capture

YS Itas, R Razali, S Tata, SA Alrub, JE Ghoul… - Silicon, 2024 - Springer
Using density functional theory, this work investigated the photocatalytic potentials of gallium
nitride nanotubes (GaNNTs) under separate do** of Si and B impurities. The study was …

The potentials of Si-doped magnesium oxide nanotubes for decontamination of pollutants

YS Itas, AM Danmadami, R Razali… - Physica Scripta, 2023 - iopscience.iop.org
This work investigated the potential of the silicon-doped magnesium oxide nanotubes (Si:
MgONT) to serve as a photocatalyst for the treatment of pollutants. The analysis of the …

Significant improvement in structural, electronic, optical and thermoelectric properties of PdTe2 in bulk and monolayer phase: A G0W0+ BSE approach

ID Yusuf, AB Suleiman, A Lawal, CE Ndikilar… - Physica B: Condensed …, 2024 - Elsevier
Using first principles calculations structural, electronic, thermoelectric and optical properties
of PdTe 2 in bulk and monolayer were investigated. The calculated lattice parameters with …