Research Article

Computational and Experimental Evaluation of Inhibition Potential of a New Ecologically Friendly Inhibitor Leaves of Date Palm (Phoenix dactylifera L.) for Aluminium Corrosion in an Acidic Media

Table 6

Quantum chemical parameters for Vanillyl Alcohol obtained by DFT/B3LYP/6-311G (d,p) level.

Inhibitor moleculeEHOMOELUMO∆EIEEA

PDL-11.26-0.2910.9711.260.295.495.783.710.091.25-0.140.1