Yoo, S.-H.: Overcoming failing Size Convergence for Surface Calculations of Materials Exhibiting Spontaneous Polarization. International Conference Materials Science and Engineering: Materials Oceania 2021, virtual, Brisbane City, Australia (2021)

Bitzek, E.; Hickel, T.; Zimmermann, M.: NFDI-MatWerk - an overview and discussion of the next steps. Webinar MaterialsWeek2021, online (2021)

Polin, N.; Giron, S.; Adabifiroozjaei, E.; Yang, Y.; Saxena, A.; Gutfleisch, O.; Gault, B.: Atomic‐scale Insights to Design of High‐Performing Hard Magnets Gained by Atom Probe Tomography. Atom Probe Tomography & Microscopy 2021 (Virtual Conference), Online (2021)

Srikakulapu, K.; Qin, Y.; Sreekala, L.; Morsdorf, L.; Herbig, M.: On the decomposition resistance of carbonitride precipitates during high-pressure torsion in X30CrMoN15-1 bearing steel. High Nitrogen Steel conference, HNS 2021, online, Shanghai, China (2021)

Todorova, M.; Surendralal, S.; Wippermann, S. M.; Deißenbeck, F.; Neugebauer, J.: Processes at solid/liquid interfaces – insights from ab initio molecular dynamics simulations with potential control. AMaSiS 2021 Online - Applied Mathematics and Simulation for Semiconductors and Electrochemical Systems, Berlin, Germany (2021)

Neugebauer, J.; Surendralal, S.; Deißenbeck, F.; Wippermann, S. M.; Todorova, M.: Identifying and understanding corrosion reactions: An ab initio approach. ICASS - 4th International Conference on Applied Surface Science, Virtual Conference (2021)

Neugebauer, J.: Ab initio descriptors to guide materials design in high-dimensional chemical and structural configuration spaces. Münchner Physik Kolloquium - Festkolloquium für Professor Winfried Petry, Technische Universität München, delivered online, München, Germany (2021)

Todorova, M.; Surendralal, S.; Wippermann, S. M.; Deißenbeck, F.; Neugebauer, J.: Insights into processes at electrochemical solid/liquid interfaces from ab initio molecular dynamics simulations. ICACES/BENCh Virtual Summer School 2021, Göttingen, Germany (2021)

Todorova, M.; Yoo, S.-H.; Vatti, A. K.; Neugebauer, J.: From Semiconductor defect chemistry to electrochemistry. ICACES/BENCh Virtual Summer School 2021, Göttingen, Germany (2021)

Neugebauer, J.: Efficient sampling of high-dimensional chemical and thermodynamic configuration spaces. ELRC2020: Invitation to Complex High-Dimensional Energy Landscapes Reunion Conference II, Delivered online, Lake Arrowhead, CA, USA (2021)

Siemer, N.: Metadata-schemes and RDM handbook in SFB1394. Workshop "Research-data management, machine learning and material informatics within the SFB/TR103", RUB, virtual, Bochum, Germany (2021)

Hickel, T.; Janßen, J.; Sözen, H. I.; Sreekala, L.; Körmann, F.; Surendralal, S.; Todorova, M.; Neugebauer, J.: High-throughput optimization of finite temperature phase stabilities: Concepts and application. ICAMS Advanced Discussions, virtual, Bochum, Germany (2021)

Neugebauer, J.: First principles first. ICAMS Advanced Discussions 2021: Recent trends in materials design, Virtual Conference, Bochum, Germany (2021)

Neugebauer, J.: Panel discussion leader. ICAMS Advanced Discussions 2021: Recent trends in materials design, Virtual Conference, Bochum, Germany (2021)

Neugebauer, J.; Zendegani, A.; Hickel, T.: Defect phase diagrams as novel tool to understand and design tailored defect structures in advanced steels. Thermec2021, Virtual Meeting, Vienna, Austria (2021)

Todorova, M.; Surendralal, S.; Wippermann, S. M.; Deißenbeck, F.; Neugebauer, J.: Insights into processes at electrochemical solid/liquid interfaces from ab initio molecular dynamics simulations. ICTP-Workshop on “Physics and Chemistry of Solid/Liquid Interfaces for Energy Conversion and Storage”, Virtual Meeting, Trieste, Italy (2021)

Neugebauer, J.: Materials design by exploiting high-dimensional chemical and structural configuration spaces. Kolloquium im Rahmen des SFB 986, Technische Universität Hamburg-Harburg, Online Meeting, Hamburg-Harburg, Germany (2021)

Todorova, M.; Surendralal, S.; Wippermann, S. M.; Deißenbeck, F.; Neugebauer, J.: Hydrogen at electrified solid/liquid interfaces – insights from ab initio molecular dynamics simulations. TYC mini-workshop on “Physics and Chemistry of Solid/Liquid Interfaces”, online, London, UK (2021)

Lymperakis, L.: Νanomaterials from first principles. Seminar: Programme of Postgraduate course Materials Physics and Technology, Department of Physics, Aristotle University of Thessaloniki, Thessaloniki, Greece (2021)

Hickel, T.; Janßen, J.; Sözen, H. I.; Körmann, F.; Surendralal, S.; Todorova, M.; Neugebauer, J.: High-throughput optimization of finite temperature phase stabilities: Concepts and application. Thermec'2021, Virtual Conference, Graz, Austria (2021)