Insights into the pressure-dependent physical properties of cubic Ca3MF3 (M= As and Sb): First-principles calculations
Here, first-principles calculations have been employed to make a comparative study on
structural, mechanical, electronic, and optical properties of new Ca 3 MF 3 (M= As and Sb) …
structural, mechanical, electronic, and optical properties of new Ca 3 MF 3 (M= As and Sb) …
II–VI Semiconductor-Based Conductometric Gas Sensors: Is There a Future for These Sensors?
G Korotcenkov - Sensors, 2024 - mdpi.com
A review of the state of research in the development of conductometric gas sensors based
on II–VI semiconductors is given. It was shown that II–VI compounds indeed have properties …
on II–VI semiconductors is given. It was shown that II–VI compounds indeed have properties …
DFT based investigations on inherent CO2 adsorption and direct dissociation capability of Ti2C and Nb2C mxenes
Transition metal carbide MXenes, specifically Ti 2 C and Nb 2 C, have been investigated for
their ability to efficiently adsorb and dissociate CO 2 using First Principles Calculations …
their ability to efficiently adsorb and dissociate CO 2 using First Principles Calculations …
The removal of elemental aluminium and its ions using some heteroatom-decorated graphitic carbonitride nanosheets: a DFT study
NA Kahi, S Rezaei - Molecular Simulation, 2024 - Taylor & Francis
In this work, we have investigated the possibility of adsorption and removal of both metallic
aluminium (Al (0)) and Al (III) ions from the environment by applying some heteroatom …
aluminium (Al (0)) and Al (III) ions from the environment by applying some heteroatom …
Enhanced electro-optical properties of CdS thin films through Sb nanosheets coating
RA Almotiri, AF Qasrawi, LOA Samen - Optical and Quantum Electronics, 2024 - Springer
Cadmium sulfide thin films are deposited using the thermal evaporation technique and
coated with 50 nm thick Sb nanosheets. Both the coated and uncoated films undergo …
coated with 50 nm thick Sb nanosheets. Both the coated and uncoated films undergo …
Study on the photoelectric and electromagnetic properties of nonmetal elements X (X= B, C, N) doping bilayer CdS
J Wen, M Shi, G Chen, S Li - Materials Science in Semiconductor …, 2025 - Elsevier
In this paper, the electronic, magnetic and optical properties of nonmetal elements doping
BL-CdS systems are calculated by DFT+ U. The stable structures of nonmetal elements …
BL-CdS systems are calculated by DFT+ U. The stable structures of nonmetal elements …