This review article explores into the complicated relationship between electrochemistry and
2D materials, exploring their mutual influences and the consequential advancements in …

Context In this research, CO2 and NO2 adsorption on doped nanographene (NG) sheets
with transition metals (Fe, Ni, Zn) and (Mn, Co, Cu), respectively, have been applied for …

A magnesium-decorated graphene quantum dot (C24H12-Mg) surface has been examined
theoretically using density functional theory (DFT) computations at the ωB97XD/6-311++ G …

The application of nickel complexes of nicotinic acid hydrazide ligand as a potential gas-
sensor and adsorbent material for H2S gas was examined using appropriate density …

In view of the research-substantiated comparative efficiency of nontoxic and bioavailable
nanomaterials synergic with human systems for drug delivery, this work was aimed at …

Nanomaterials have been used for different applications including sensing environmental
gases. Exposure to hazardous gas in the environment leads to major health issues such as …

Density functional theory calculations are carried out to investigate the adsorption behaviors
of CO2, NO, CO, and NH3 on 12 fullerene-like X12Y12 (B12N12, Al12N12, Ga12N12 …

The applications of 3D inorganic nanomaterials in environmental and agriculture monitoring
have been exploited continuously; however, the utilization of semiconductor nanoclusters …

While hydrogen combustion generates a lot of energy and can be done in a variety of ways,
the primary challenge in utilizing hydrogen energy is obtaining an efficient hydrogen storage …

The density functional theory (DFT) is applied to theoretically study the capture and storage
of three different nitro polycyclic aromatic hydrocarbons, 4-nitrophenol, 2-nitrophenol, and 9 …