In recent years, photocatalysis has gained particular attention due to its crucial potential
applications in addressing many essential energy and environmental challenges …

The recent advances in the field of 2D hexagonal boron nitride (hBN) for realizing electronic
and optoelectronic devices, including wearable and portable devices, have aroused …

Nanostructured gas sensors find diverse applications in environmental and agricultural
monitoring. Herein, adsorption of phosgene (COCl2) on pure and copper-decorated …

Through density functional theory (DFT) computations, the adsorption behavior and
electronic sensitivity of the mustard gas are scrutinized towards a Ca 12 O 12 nanocluster …

Hydrogen is clean energy source that can replace fossil fuels, considering the great need for
clean and environmentally friendly energy. Researchers are busy develo** new materials …

Under ab initio computations, several new inorganic electride compounds with high stability,
M@ x-Al12N12 (M= Li, Na, and K; x= b 66, b 64, and r 6), were achieved for the first time by …

Memristor-based sensors have been investigated as innovative gas sensors owing to their
advantages, including high-response and room-temperature (RT) operation. We …

The energetic and electronic sensitivities of a borophene sheet (B 36) toward four
nucleobases including adenine (A), guanine (G), thymine (T), and cytosine (C) are studied …

Using density functional theory calculations, the electronic sensitivity and reactivity of
pristine, Al and Si doped C 70 fullerenes are inspected toward anti-tuberculosis isoniazid …

Gas sensor, as one of the most important devices to detect noxious gases, provides a vital
way to monitor the concentration and environmental information of gas in order to guarantee …