Articles

type: Journal
Title DOI Date
A combined experimental and density functional theory investigation of the reaction between β-Nitrostyrene and trimethylsilyl cyanide https://doi.org/10.1016/j.rechem.2025.102884 2025 - 11
Using isopropanol as a liquid organic hydrogen carrier (LOHC) for the reduction nitroarenes employing Au/Ag decorated carbon aerogels https://doi.org/10.1016/j.jics.2025.102116 2025 - 10
A synthesis, characterization and catalytic application of CNT aerogels for conversion of β-nitrostyrenes to arylhydrazones https://doi.org/10.57647/j.ijc.2025.1503.25 2025 - 08
Synthesis, characterization, and catalytic application of biocompatible chitosan-graphene oxide aerogel in the retro-aza-Henry-type conversion https://doi.org/10.1016/j.jics.2025.101875 2025 - 07
Theoretical study of Ni, Co and Cu single atom catalysts for CO2 to formic acid reduction https://doi.org/10.1016/j.surfin.2025.106726 2025 - 05
Comparative DFT, NBO, and AIM studies on the sensing and adsorption abilities of simple and doped graphene nanosheets for phosphine gas https://doi.org/10.1016/j.cocom.2025.e01046 2025 - 05
Near infrared photodetection based on a graphene/intercalated graphene junction https://doi.org/10.1109/JPHOT.2025.3563447 2025 - 03
Retro-aza-Henry-type conversion of β-nitrostyrenes to the related hydrazones using ascorbic acid-functionalized graphene as a catalyst https://doi.org/10.1007/s13738-025-03194-z 2025 - 03
Diastereoselective electrochemical coupling of beta-nitrostyrenes using constant-current conditions https://doi.org/10.1016/j.rechem.2025.103216 2025 - 02
Diastereoselective electrochemical coupling of beta-nitrostyrenes using constant-current conditions https://doi.org/10.1016/j.rechem.2025.102116 2025 - 02
The regioselectivity in the gold-catalyzed cycloisomerization of alcohols: A full DFT study on carbene versus non-carbene mechanisms https://doi.org/10.1007/s11164-024-05459-3 2025 - 01
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
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
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
Solvent-Free Synthesis of ?-Cyanophosphonates from ?-Nitrostyrenes by Using a Deep-Eutectic Solvent Catalyst 10.1055/a-2239-6819
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
type:
Title Date
Recent advances and new trends in the use of deep eutectic solvents in organic synthesis and other applications 2025 - 05
Alumina-supported cobalt, nickel, and copper single-atom catalysts for CO to CO2 conversion; A comparative DFT study 2025 - 05
Density functional theory study of nickel and copper single-atom catalysts on graphitic carbon nitride for benzene to phenol oxidation 2025 - 04
DFT Study of the Possible Mechanisms for Synthesizing α-Cyanophosphonates from β-Nitrostyrenes 2025 - 04