Regulating the electronic properties of MoSe2 to improve its CO2 electrocatalytic reduction performance via atomic doping
Sign Up to like & getrecommendations! Published in 2021 at "New Journal of Chemistry"
DOI: 10.1039/d0nj05993e
Abstract: The atomic environment should heavily influence the performance of CO2 reduction, and the regulated electronic property of reaction intermediates and metals (Cu) is responsible for the high catalytic performance of CH4 production. read more here.
Keywords: co2; performance; properties mose2; regulating electronic ... See more keywords
Electronic properties of MoSe2 nanowrinkles.
Sign Up to like & getrecommendations! Published in 2024 at "Nanoscale"
DOI: 10.1039/d3nr06261a
Abstract: Mechanical deformations, either spontaneously occurring during sample preparation or purposely induced in their nanoscale manipulation, drastically affect the electronic and optical properties of transition metal dichalcogenide monolayers. In this first-principles work based on density-functional theory,… read more here.
Keywords: electronic properties; mose2 nanowrinkles; properties mose2;
Effect of arsenic doping on structural and electronic properties of MoSe2 monolayer: an ab initio study
Sign Up to like & getrecommendations! Published in 2024 at "Condensed Matter Physics"
DOI: 10.5488/cmp.27.43602
Abstract: In this paper, we studied the structural and electronic properties of MoSe2 monolayer in its pure and doped forms, using the density functional theory (DFT), and the calculations were performed using Quantum Espresso (QE) software… read more here.
Keywords: system; structural electronic; electronic properties; mose2 monolayer ... See more keywords