Nikolaos Lembesisمشاهده پروفایل
استادیار
Nikolaos Lembesis is a tenured Assistant Professor in the Department of Chemistry at the University of Ioannina, specializing in Theoretical Physical Chemistry and Computational Chemistry. His research develops multi-scale computational simulation methods to understand structure-property relationships of matter for applications in energy, environment, and quality of life improvement. His educational background includes: PhD in Chemical Engineering, National Technical University of Athens (2013) BSc in Chemical Engineering, Technical University of Munich (2007) BSc and MSc in Chemical Engineering, National Technical University of Athens (2007) Dr. Lembesis's research integrates molecular dynamics, ab initio simulations, and stochastic methods to model materials at atomic-to-macroscopic scales. His group investigates perovskite solar cell interfaces, droplet absorption phenomena, and defect engineering using advanced computational techniques including classical/ab initio molecular dynamics and high-performance computing. Analysis of his 15 most recent publications (2023-2025) reveals dominant focus on perovskite photovoltaics, with recurring themes of interface engineering, strain manipulation, and defect passivation to enhance efficiency and stability. Key subfields include crystal orientation control, wide-bandgap perovskite optimization, and novel monolayer interface designs. His group offers undergraduate and master's thesis opportunities in Computational Chemistry, providing training in molecular simulation techniques, Unix/Linux systems, HPC resources, and software development for materials modeling. The research team utilizes multi-scale simulation approaches to study water-perovskite interactions, organic monolayer protection mechanisms, and thermomechanical properties of advanced materials, with strong emphasis on bridging computational predictions with experimental validation.






