Chemical reactivity from a conceptual density functional theory perspective
Ranita Pal, Pratim Kumar Chattaraj
Topics & Concepts
ElectronegativityPolarizabilityChemistryFukui functionReactivity (psychology)Density functional theoryComputational chemistryPerspective (graphical)Chemical physicsMoleculeOrganic chemistryArtificial intelligenceElectrophilePathologyCatalysisComputer scienceMedicineAlternative medicineAdvanced Chemical Physics StudiesAdvanced Physical and Chemical Molecular InteractionsMachine Learning in Materials Science