Adsorption and gas sensing properties of Cun and Pdn (n= 1–3) clusters modified MoSe2 for lithium battery thermal runaway gases
H Wu, J Fang, S Yuan, Y Liu, J Zeng, T Jiang - Applied Surface Science, 2024 - Elsevier
The manuscript mainly explores the adsorption behavior and related parameters of Cu n
and Pd n (n= 1–3) clusters modified MoSe 2 substrates for thermal runaway gases (CO, CO …
and Pd n (n= 1–3) clusters modified MoSe 2 substrates for thermal runaway gases (CO, CO …
NH3, PH3 and AsH3 adsorption on alkaline earth metal (Be-Sr) doped graphenes: Insights from DFT calculations
H Luo, L Zhang, S Xu, M Shi, W Wu, K Zhang - Applied Surface Science, 2021 - Elsevier
To bring more safety assurance to human's life, effectively monitoring and suppressing NH
3, PH 3, and AsH 3 gases is highly demanded. In this study, NH 3, PH 3 and AsH 3 …
3, PH 3, and AsH 3 gases is highly demanded. In this study, NH 3, PH 3 and AsH 3 …
DFT investigation of transition metal-doped graphene for the adsorption of HCl gas
H Tang, Y Xiang, H Zhan, Y Zhou, J Kang - Diamond and Related Materials, 2023 - Elsevier
Graphene-based toxic HCl gas sensors and adsorption materials are seldom reported.
Utilizing density functional theory (DFT), the adsorption energy, charge density, and density …
Utilizing density functional theory (DFT), the adsorption energy, charge density, and density …
Synthesis of carbon nanotubes by direct liquid injection chemical vapor deposition method and its relevance for developing an ultra-sensitive room temperature based …
The present paper reports the synthesis and characterization of Multiwalled Carbon
Nanotube (MWCNT) based thin film and its application as a CO 2 gas sensor. The MWCNT …
Nanotube (MWCNT) based thin film and its application as a CO 2 gas sensor. The MWCNT …
Growth of Fe doped ZnO nanoellipsoids for selective NO2 gas sensing application
Abstract In this work, Undoped ZnO and Fe-doped ZnO nanostructures were successfully
synthesized by using the simple hydrothermal method and their structural, morphological by …
synthesized by using the simple hydrothermal method and their structural, morphological by …
Enhancement of room temperature Ethanol sensing by optimizing the density of Vertically Aligned Carbon Nanofibers decorated with Gold nanoparticles
M Shooshtari, LN Sacco, J Van Ginkel, S Vollebregt… - Materials, 2022 - mdpi.com
An ethanol gas sensor based on carbon nanofibers (CNFs) with various densities and
nanoparticle functionalization was investigated. The CNFs were grown by means of a …
nanoparticle functionalization was investigated. The CNFs were grown by means of a …
NH3, PH3, AsH3 adsorption and sensing on rare earth metal doped graphene: DFT insights
H Luo, K Xu, Z Gong, N Li, K Zhang, W Wu - Applied Surface Science, 2021 - Elsevier
To explore new sensor materials towards hazardous gases NH 3, PH 3, and AsH 3, their
adsorptions on pristine graphene and rare earth metal (REM= La, Ce, Nd, Pm, Sm, Eu and …
adsorptions on pristine graphene and rare earth metal (REM= La, Ce, Nd, Pm, Sm, Eu and …
Adsorption of NO and NO2 molecules on defected-graphene and ozone-treated graphene: first-principles analysis
High sensitivity of ozone-treated graphene towards detecting NO 2 is experimentally
reported in literature with a sensor response reaching 1.3 ppb at room temperature. The …
reported in literature with a sensor response reaching 1.3 ppb at room temperature. The …
High selectivity of N-doped ZnO nano-ribbons in detecting H2, O2 and CO2 molecules: Effect of negative-differential resistance on gas-sensing
Adsorption and transport properties of ZnO nano-ribbons (ZnO-NRs) are investigated using
density-functional theory (DFT) combined with non-equilibrium Green's-function (NEGF) …
density-functional theory (DFT) combined with non-equilibrium Green's-function (NEGF) …
Theoretical study of the adsorption and sensing properties of pure and metal doped C24N24 fullerene for its potential application as high-performance gas sensor
H Xu, X Tu, X Wang, X Liu, G Fan - Materials Science in Semiconductor …, 2021 - Elsevier
Density functional theory (DFT) calculation was used to study the potential applications of
pure and metal-doped C 24 N 24 fullerene as highly sensitive and selective gas sensors. It …
pure and metal-doped C 24 N 24 fullerene as highly sensitive and selective gas sensors. It …