Neugebauer, J.; Lymperakis, L.; Janßen, J.; Huber, L.; Hickel, T.: Modeling crystal growth and materials design in high dimensional chemical and structural configuration spaces. German Conference on Crystal Growth DKT 2020, München/Garching, Germany (2020)

Neugebauer, J.; Janßen, J.; Huber, L.; Ikeda, Y.; Körmann, F.; Grabowski, B.; Hickel, T.; Shapeev, A.: Materials Design in High Dimensional Chemical and Structural Configuration Spaces. TMS 2020 Annual Meeting & Exhibition, San Diego, CA, USA (2020)

Körmann, F.; Ikeda, Y.; Srinivasan, P.; Dutta, B.; Neugebauer, J.; Grabowski, B.; Kostiuchenko, T.; Shapeev, A.: Ab Initio Phase Stabilities of High Entropy and Chemically Complex Alloys. TMS Annual Meeting, San Diego, CA, USA (2020)

Hickel, T.: Application of Density Functional Theory in the Context of Phase Diagram Modelling. MSIT Winter School on Materials Chemistry, Virtual Event, Castle Ringberg, Tegernsee (2020)

Zhao, H.; Huber, L.; Lu, W.; Peter, N. J.; An, D.; De Geuser, F.; Dehm, G.; Ponge, D.; Neugebauer, J.; Gault, B. et al.; Ponge, D.; Raabe, D.: Interplay of chemistry and faceting at grain boundaries in a model Al-alloy. TMS Annual Meeting & Exhibition, San Diego, CA, USA (2020)

Hickel, T.; McEniry, E.; Nazarov, R.; Dey, P.: Ab initio basierte Simulation zur Wasserstoffversprödung in hoch-Mn Stählen. Seminar der Staatlichen Materialprüfungsanstalt Darmstadt, Institut für Werkstoffkunde, Darmstadt, Germany (2020)

Hickel, T.; Aydin, U.; Sözen, H. I.; Dutta, B.; Pei, Z.; Neugebauer, J.: Innovative concepts in materials design to boost renewable energies. Seminar of Institute for Innovative Technologies, SRH Berlin University of Applied Sciences, Berlin, Germany (2020)

Neugebauer, J.; Janßen, J.; Huber, L.; Körmann, F.; Hickel, T.; Grabowski, B.: Construction and exploitation of large ab initio data spaces to design materials with superior mechanical properties. MRS-J: Materials Research Meeting 2019, Yokohama, Japan (2019)

Janßen, J.; Hickel, T.; Neugebauer, J.: Automated ab-initio Determination of Materials Properties at finite Temperatures with pyiron. CNLS Seminar, Los Alamos, NM, USA (2019)

Todorova, M.; Yoo, S.-H.; Surendralal, S.; Neugebauer, J.: Predicting atomic structure and chemical reactions at solid-liquid interfaces by first principles. Operando surface science – Atomistic insights into electrified solid/liquid interfaces (708. WE-Heraeus-Seminar), Physikzentrum, Bad Honnef, Germany (2019)

Neugebauer, J.: Machine Learning in Materials: Screening and Discovery. National Institute of Advanced Industrial Science and Technology (AIST), Tsukuba, Japan (2019)

Raabe, D.; Neugebauer, J.; Körmann, F.; Rao, Z.; Gault, B.; Lu, W.; Li, Z.: Metastability High Entropy Alloy Design. MRS Fall Conference, Boston, MA, USA (2019)

Neugebauer, J.; Janßen, J.; Körmann, F.; Hickel, T.; Grabowski, B.: Ab initio descriptors to design materials with superior mechanical properties. Materials Day, ETH Zürich, Zürich, Switzerland (2019)

Liebscher, C.; Stoffers, A.; Alam, M.; Lymperakis, L.; Cojocaru-Mirédin, O.; Gault, B.; Neugebauer, J.; Scheu, C.; Raabe, D.; Meiners, T. et al.; Frolov, T.; Dehm, G.: How do grain boundaries transform on the atomic level? International Workshop on Advanced and In-situ Microscopies of Functional Nanomaterials and Devices, IAMNano 2019, Düsseldorf, Germany (2019)

Ikeda, Y.; Neugebauer, J.; Körmann, F.: Interstitial alloying and stacking-fault energies in CrMnFeCoNi. 3rd German-Dutch Workshop on “Computational Materials Science” , Domburg, The Netherlands (2019)

Lymperakis, L.: Ab-initio based investigations of surface reconstructions and strain effects on the compositional limits of ternary III-Nitride alloys. National Institute of Advanced Industrial Science and Technology (AIST) Colloquium, Tsukuba, Japan (2019)

Lymperakis, L.: Ab-initio based description and design of nitride surfaces: The role of surface rehybridization on alloy composition and ordering. Materials Research Meeting 2019 (Materials Research Society of Japan), Yokohama, Japan (2019)

Raabe, D.; Ponge, D.; Kwiatkowski da Silva, A.; Makineni, S. K.; Katnagallu, S.; Stephenson, L.; Kontis, P.; Freysoldt, C.; Neugebauer, J.; Gault, B.: Chemistry at Lattice Defects Probed at Atomic Scale. 20th International Union of Materials Research Societies International Conference in Asia IUMRS, Perth, Australia (2019)

Ikeda, Y.; Ishibashi, S.; Neugebauer, J.; Körmann, F.: Tuning stacking-fault energies and local lattice distortions in high-entropy alloys. Theory of Complex Disorder in Materials (TCDM2019) , Linköping, Sweden (2019)

Mendive-Tapia, E.: Ab-initio Free energy of antiferromagnetic phases: a hierarchy of local moment correlation functionsAb-initio Free energy of antiferromagnetic phases: a hierarchy of local moment correlation functions. Current Research in Magnestism (CRIM) 2019: Recent advances in Antiferromagnetism, London, UK (2019)