Perovskite materials have attracted significant interest due to their distinctive electronic and
optical properties, making them highly suitable for various electronic and optical devices …

To investigate the application of modified hexagonal boron nitride (h-BN) in the detection
and monitoring of harmful gases (NO2, NO, NH3, and CO), first-principles calculations are …

When partial discharges occur in air-insulated equipment, the air decomposes to produce a
variety of contamination products, resulting in a reduction in the insulation performance of …

Air discharge characteristic gas detection is considered as one of the most reliable methods
in fault diagnosis of air switchgear. Based on the first-principles of density functional theory …

In this study, the gas sensing properties of formaldehyde (HCHO) and benzene (C6H6)
adsorbed on two-dimensional (2D) pristine GeSe and Pd-decorated GeSe (Pd–GeSe) …

Oxygen-containing toxic gases such as CO and NO x (x= 1, 2) have presented significant
challenges to both the atmospheric environment and human well-being, thus prompting the …

Urbanization and industrialization processes inevitably release a large amount of nitrogen-
containing toxic gases (NTGs) such as NO, NO 2, NH 3 and HCN, posing a serious threat to …

Realizing industrial applications for online monitoring and scavenging of hazardous gases
(SO 2 and SO 2) is essential. In this study, utilizing density functional theory (DFT), electronic …

Industrial emissions, particularly CO and SO 2, pose significant threats to both the ecological
environment and human health, highlighting the critical need for online monitoring and the …

In order to demonstrate the feasibility of fullerenol-based toxic fluoride gas sensing, the
density functional theory is utilized for adsorption mechanism study. The dominant …