Khayatan, N.; Prabhakar, J. M.; Jalilian, E.; Madelat, N.; Terryn, H.; Rohwerder, M.: On the rate determining step of cathodic delamination of delamination-resistant organic coatings. Corrosion Science 239, 112396 (2024)
Khayatan, N.: Investigation of Key Parameters in Cathodic Delamination of Organic Coatings and Quantification of Their Role. Dissertation, Ruhr-Univesität Bochum, Fakultät Maschinenbau (2023)
Max Planck scientists design a process that merges metal extraction, alloying and processing into one single, eco-friendly step. Their results are now published in the journal Nature.
Scientists of the Max-Planck-Institut für Eisenforschung pioneer new machine learning model for corrosion-resistant alloy design. Their results are now published in the journal Science Advances
It is very challenging to simulate electron-transfer reactions under potential control within high-level electronic structure theory, e. g. to study electrochemical and electrocatalytic reaction mechanisms. We develop a novel method to sample the canonical NVTΦ or NpTΦ ensemble at constant electrode potential in ab initio molecular dynamics…