Articles

type: Journal
Title DOI Date Conference / journal
A combined experimental and density functional theory investigation of the reaction between ?-Nitrostyrene and trimethylsilyl cyanide 10.1016/j.rechem.2025.102884 Results in Chemistry
Using isopropanol as a liquid organic hydrogen carrier (LOHC) for the reduction nitroarenes employing Au/Ag decorated carbon aerogels 10.1016/j.jics.2025.102116 JOURNAL OF THE INDIAN CHEMICAL SOCIETY
A synthesis, characterization and catalytic application of CNT aerogels for conversion of ?-nitrostyrenes to arylhydrazones 10.57647/j.ijc.2025.1503.25 Iranian Journal of Catalysis
Synthesis, characterization, and catalytic application of biocompatible chitosan-graphene oxide aerogel in the retro-aza-Henry-type conversion 10.1016/j.jics.2025.101875 JOURNAL OF THE INDIAN CHEMICAL SOCIETY
Theoretical study of Ni, Co and Cu single atom catalysts for CO2 to formic acid reduction 10.1016/j.surfin.2025.106726 Surfaces and Interfaces
Comparative DFT, NBO, and AIM studies on the sensing and adsorption abilities of simple and doped graphene nanosheets for phosphine gas 10.1016/j.cocom.2025.e01046 Computational Condensed Matter
Density functional theory study of nickel and copper single-atom catalysts on graphitic carbon nitride for benzene to phenol oxidation 10.1038/s41598-025-95763-8 Scientific Reports
Alumina-supported cobalt, nickel, and copper single-atom catalysts for CO to CO2 conversion; a comparative DFT study 10.1016/j.rechem.2025.102236 Results in Chemistry
Retro-aza-Henry-type conversion of B-nitrostyrenes to the related hydrazones using ascorbic acid-functionalized graphene as a catalyst 10.1007/s13738-025-03194-z Journal of the Iranian Chemical Society JICS
Recent advances and new trends in the use of deep eutectic solvents in organic synthesis and other applications 10.1016/j.molliq.2025.127510 JOURNAL OF MOLECULAR LIQUIDS
DFT Study of the Possible Mechanisms for Synthesizing a-Cyanophosphonates from B-Nitrostyrenes 10.1002/adts.202500379 Advanced Theory and Simulations
Diastereoselective electrochemical coupling of beta-nitrostyrenes using constant-current conditions 10.1016/j.rechem.2025.102116 Results in Chemistry
Near-infrared photodetection based on a graphene/intercalated-graphene junction 10.1109/JPHOT.2025.3563447 IEEE Photonics Journal
Single-atom catalysts (SACs) for CO <sub>2</sub> to CO conversion using Cu, Ni, and Co on graphene flakes support; a DFT study 10.1080/1536383X.2024.2412665 FULLERENES NANOTUBES AND CARBON NANOSTRUCTURES
The regioselectivity in the gold-catalyzed cycloisomerization of alcohols: a full DFT study on carbene versus non-carbene mechanisms 10.1007/s11164-024-05459-3 RESEARCH ON CHEMICAL INTERMEDIATES
Theoretical study of the efficiencies of graphyne supported Mo single-atom catalyst (SAC) and Mo-Ni dual-atom catalyst (DAC) on hydrogen evolution reaction 10.1080/1536383X.2024.2409765 FULLERENES NANOTUBES AND CARBON NANOSTRUCTURES
Solvent-Free Synthesis of ?-Cyanophosphonates from ?-Nitrostyrenes by Using a Deep-Eutectic Solvent Catalyst 10.1055/a-2239-6819 SYNLETT
A mechanistic study of the electrochemical reaction between nitrostyrene and benzaldehyde: DFT calculations on all possible routes and intermediates 10.1007/s11164-024-05382-7 RESEARCH ON CHEMICAL INTERMEDIATES
Employing nano-SnFe2O4 in the synthesis of arylbenzimidazoles, the computational study of the reaction mechanism, and examining the products as putative human transmembrane protein activators 10.1007/s11164-023-05065-9
The theoretical study of electron-induced trimerization of acrylic acid anion radical in the gas phase 10.1007/s11164-023-05019-1