Andreas Douloumis University of Crete, Greece Electronic structure of photocatalytic materials: doped ZnO and gold-perovskite interfaces | Andreu de Donato Pérez Universitat de Barcelona, Spain Global optimization and thermodynamic phase diagrams of IrOx particles | Ivan Radovic Vinca Institute of Nuclear Sciences, Serbia Wake potential in graphene-insulator-graphene heterostructure: the role of graphene-insulator distance |
Labanya Bhattacharya Technion - Israel Institute of Technology, Israel Nature of Potential Energies at Different Levels of Theory for Different Perovskite Solar Cell Building Blocks | Lakhanlal Technion - Israel Institute of Technology, Israel Study of heat treated γ-NiFeOOH aerogel for oxygen evolution reaction using DFT | Radhey Yadav Ariel University, Israel Tri-metallic alloys as an electro-catalyst for fuel cells – The case of MF on Pt3Pd3Sn2 |
Ricardo Urrego-Ortiz Universitat de Barcelona, Spain How DFT Errors Spread in Computational Electrocatalysis Models | Shkëndije Haziri Sefa University for Business and Technology , Kosovo Using MC Simulation to study the solution/solvent interaction between O2 formed on the surface of hematite | Veton Haziri University for Business and Technology , Kosovo Theoretical and EIS investigation of the formation of oxygen on the surfaces of different materials |
Vipin Kumar University of Grenoble Alpes, Grenoble, France Oxygen reduction reaction on pristine and N-doped nanosheet comparison study by implicit and explicit solvent model | Dorota Rutkowska-Zbik Jerzy Haber Institute of Catalysis and Surface Chemistry, Poland DFT studies on Cun/TiO2 (n=1-6) system for water splitting | Noam Hadari Technion - Israel Institute of Technology, Israel An efficient model to describe lattice mismatched interface system |
Neeraj Mishra, Ben-Gurion University Israel Nanoscale growth of metastable π-SnS by impurity addition or choice of substrate |
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