Potential Corrosion Inhibition Properties of Flavone Derivatives on the Cu(111) Surface: A Combined DFT and Monte Carlo Simulation Study
Rebaz Anwar Omer, Yousif Hussein Azeez, Rebaz Obaıd Kareem, Lana Omer Ahmed, Damir A. Safin
Topics & Concepts
ChemistryMonte Carlo methodAdsorptionCorrosionMoleculeComputational chemistryCopperMetalStereochemistryCrystallographyPhysical chemistryOrganic chemistryMathematicsStatisticsCorrosion Behavior and InhibitionBioactive Compounds and Antitumor AgentsMulticomponent Synthesis of Heterocycles