Chemical interaction, self-ordering and corrosion inhibition properties of 2-mercaptobenzothiazole monolayers: DFT atomistic modeling on metallic copper
Fatah Chiter, Dominique Costa, Vincent Maurice, Philippe Marcus
Topics & Concepts
MonolayerCopperVacancy defectDensity functional theoryDissolutionMaterials scienceMetalOxideChemical physicsAdsorptionCorrosionMoleculeInorganic chemistryCrystallographyComputational chemistryChemistryPhysical chemistryNanotechnologyMetallurgyOrganic chemistryCorrosion Behavior and InhibitionMolecular Junctions and NanostructuresElectrocatalysts for Energy Conversion