Mechanistic insights into acid orange 7 azo dye (AO7) reduction using DFT calculations
Izzeddine Sameut Bouhaik, M. Hadj Méliani, Rami K. Suleiman, Tawfik A. Saleh
Topics & Concepts
ElectrophileChemistryNucleophileRedoxDensity functional theoryFukui functionReactivity (psychology)Computational chemistryReaction mechanismGibbs free energyHybrid functionalCombinatorial chemistryOrganic chemistryThermodynamicsCatalysisPhysicsAlternative medicineMedicinePathologyNanomaterials for catalytic reactionsFree Radicals and AntioxidantsAdvanced oxidation water treatment