Materials Research Bulletin, Journal Year: 2023, Volume and Issue: 165, P. 112290 - 112290
Published: April 20, 2023
Language: Английский
Materials Research Bulletin, Journal Year: 2023, Volume and Issue: 165, P. 112290 - 112290
Published: April 20, 2023
Language: Английский
Microchemical Journal, Journal Year: 2024, Volume and Issue: 201, P. 110614 - 110614
Published: April 23, 2024
Language: Английский
Citations
7Ceramics International, Journal Year: 2024, Volume and Issue: 50(17), P. 30552 - 30559
Published: May 23, 2024
Language: Английский
Citations
7Sensors and Actuators B Chemical, Journal Year: 2024, Volume and Issue: 420, P. 136427 - 136427
Published: Aug. 8, 2024
Language: Английский
Citations
7Langmuir, Journal Year: 2024, Volume and Issue: 40(19), P. 10334 - 10345
Published: May 1, 2024
The utilization and selectivity of single atoms have garnered significant attention among researchers. However, they are easy to agglomerate because their high surface energy. To overcome this challenge, it is crucial seek suitable carriers anchor metal achieve optimal performance. In work, the structures transition embedded in hexagonal boron nitride (MB2N2, M = Fe, Co, Ni, Cu, Zn) constructed used for adsorption sensing lithium battery thermal runaway gases (H2, CO, CO2, CH4) through DFT method. behavior MB2N2 was evaluated energy, sensitivity, recovery time. calculation results indicate that CoB2N2 exhibits strong capacity both H2 CO. sensitivity FeB2N2 toward CO as 3.232 × 1016. Subsequently, mechanism studied TDOS PDOS, showed hybridization between orbitals enhanced gas This study presents novel approaches designing single-atom developing sensors detecting gases.
Language: Английский
Citations
6Langmuir, Journal Year: 2023, Volume and Issue: 40(1), P. 1058 - 1071
Published: Dec. 26, 2023
To investigate the application of modified hexagonal boron nitride (h-BN) in detection and monitoring harmful gases (NO2, NO, NH3, CO), first-principles calculations are applied to study geometric structure electronic behavior adsorption system. In this paper, four sites, namely, B, N, bridge, hollow considered explore stable metals (M = Rh, Pd, Ag, Ir, Pt, Au) on BN surface. The calculation results demonstrate that structures metal at N-site relatively stable. Subsequently, different NO2, CO M-BN researched. electron transfer, charge difference density, work function calculated. show have strongest capacity Ir-BN system, with energies −2.705, −5.064, −3.757 eV, respectively. Pt-BN system has an excellent performance (−2.251 eV) for NH3. Compared increases after adsorbing while it decreases This shows h-BN modification is a potential material online gases.
Language: Английский
Citations
16Journal of Electronic Materials, Journal Year: 2023, Volume and Issue: 52(11), P. 7315 - 7324
Published: Aug. 23, 2023
Language: Английский
Citations
14Materials Research Bulletin, Journal Year: 2023, Volume and Issue: 165, P. 112332 - 112332
Published: May 8, 2023
Language: Английский
Citations
13Physica E Low-dimensional Systems and Nanostructures, Journal Year: 2024, Volume and Issue: 159, P. 115934 - 115934
Published: Feb. 20, 2024
Language: Английский
Citations
5Sensors & Diagnostics, Journal Year: 2023, Volume and Issue: 2(4), P. 878 - 886
Published: Jan. 1, 2023
ZnO microspheres loaded with Ag nanoparticles were synthesized and exhibited good light-driven CH 4 sensing performance.
Language: Английский
Citations
12Sensors and Actuators B Chemical, Journal Year: 2023, Volume and Issue: 400, P. 134879 - 134879
Published: Nov. 2, 2023
Language: Английский
Citations
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