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Density functional theory (DFT) as a powerful tool for designing new organic corrosion inhibitors. Part 1: An overview

Materials ScienceChemical EngineeringEngineeringPhysicochemical AnalysisCorrosionNatural SciencesPhysical ChemistryPowerful ToolComputational ChemistryQuantum ChemistryChemistryMetal-organic PolyhedronCorrosion Inhibition