A novel high-performance methane sensor based on Ti-Decorated 2D γ-graphyne: A dispersion-corrected DFT insight

S Nikmanesh, R Safaiee, MH Sheikhi - Materials Chemistry and Physics, 2021 - Elsevier
In the present theoretical study, the effect of methane adsorption on the electronic properties
of titanium (Ti)-decorated γ-graphyne (γ-GY) is investigated. To this end, the dispersion …

Novel H 2 S multifunctional sensing materials: Cu or Ag-decorated (4, 4) SWSiC nanotubes

R Safaiee, MM Golshan, M Khalifeh - Journal of Materials Chemistry C, 2022 - pubs.rsc.org
Density functional theory employing Grimme's D3 method was used to study the H2S
sensing ability of pristine, as well as Cu or Ag decorated,(4, 4) SWSiC nanotubes (NTs). The …