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First principle investigation of H2Se, H2Te and PH3 sensing based on graphene oxide
(
Elsevier
, 2020 , Article)
Detecting toxic gases is of great importance to protect our health and preserve the quality of life. In this work, graphene (G) and graphene oxide with three different modifications (G–O, G–OH, and G–O–OH) have been used ...
DFT investigation of H2S adsorption on graphenenanosheets and nanoribbons: Comparative study
(
Elsevier
, 2020 , Article)
Graphenenanosheet (GNS), armchair graphenenanoribbon (AGNR), and zigzag graphenenanoribbon (ZGNR) systems were investigated by first principle calculations using the density functional theory (DFT). The DFT calculations ...
CO, CO2, and SO2 detection based on functionalized graphene nanoribbons: First principles study
(
Elsevier
, 2020 , Article)
In this study, density functional theory (DFT) has been used to build armchair graphene nanoribbon (AGNR) gas sensor and study its capacity to detect carbon monoxide (CO), carbon dioxide (CO2), and sulfur dioxide (SO2) ...
Fabrication of H2S gas sensors using ZnxCu1-xFe2O4 nanoparticles
(
Springer
, 2020 , Article)
Spinel ferrite nanoparticles can be easily retrieved and utilized for multiple cycles due to their magnetic properties. In this work, nanoparticles of a ZnxCu1-xFe2O4 composition were synthesized by employing a sol–gel ...