Talk (1232)

761.
Talk
Neugebauer, J.: Ab initio guided design of compositionally complex alloys. Materials for energy, Digital Workshop, Bochum, Germany (2021)
762.
Talk
Huber, L.: Simulating the thermodynamics of GB phases. Seminar, Institut für Materialswissenschaft (MaWi), University of Stuttgart, delivered online, Stuttgart, Germany (2021)
763.
Talk
Freysoldt, C.; Hickel, T.; Janßen, J.; Wang, N.; Zendegani, A.: High-throughput optimization of finite temperature phase stabilities: Concepts and application. Coffee with Max Planck, virtual seminar organized by the MPIE, Düsseldorf, Germany (2021)
764.
Talk
Hickel, T.; Freysoldt, C.; Janßen, J.; Wang, N.; Zendegani, A.: High-throughput optimization of finite temperature phase stabilities: Concepts and application. Coffee with Max Planck, virtual seminar organized by the MPIE, Düsseldorf, Germany (2021)
765.
Talk
Todorova, M.; Surendralal, S.: Corrosion at the Quantum Level. Coffee with Max Planck, virtual seminar organized by the MPIE, Düsseldorf, Germany (2021)
766.
Talk
Huber, L.; Dsouza, R.; Poul, M.; Neugebauer, J.: Defect Free Energies. Interdisciplinary Centre for Advanced Materials Simulation (ICAMS) Seminar, delivered online, Bochum, Germany (2021)
767.
Talk
Neugebauer, J.; Yoo, S.-H.; Lymperakis, L.: Ab initio insights into fundamental intrinsic growth and materials limitations in group-III-nitrides. MRS 2021 Fall Meeting, Virtual Conference, Boston, MA, USA (2021)
768.
Talk
Todorova, M.; Surendralal, S.; Wippermann, S. M.; Deißenbeck, F.; Neugebauer, J.: Realistic description of processes at solid/liquid interfaces by ab initio molecular dynamics simulations with potential control. MRS 2021 Fall Meeting, Hybrid Conference, Boston, MA, USA (2021)
769.
Talk
Hickel, T.; Janßen, J.; Sözen, H. I.; Körmann, F.; Neugebauer, J.: High-throughput optimization of finite temperature phase stabilities: Concepts and application. IMWF Stuttgart, Colloquium Materials , virtual, Stuttgart, Germany (2020)
770.
Talk
Zhao, H.; Gault, B.; De Geuser, F.; Huber, L.; Lu, W.; Peter, N. J.; Ponge, D.; Raabe, D.: Segregation and precipitation at grain boundaries in an Al-Zn-Mg-Cu alloy. Advanced Metallic Systems CDT seminar, virtual, Manchester, UK (2020)
771.
Talk
Yoo, S.-H.: Investigations of materials surfaces based on density functional theory calculations. Department of Chemistry seminar, virtual, Chuncheon, Republic of Korea (2020)
772.
Talk
Ponge, D.; Kwiatkowski da Silva, A.; Makineni, S. K.; Katnagallu, S.; Zhou, X.; Mianroodi, J. R.; Stephenson, L.; Kontis, P.; Freysoldt, C.; Gault, B. et al.; Neugebauer, J.: Chemistry and Structure at Lattice Defects studied at the Atomic Scale. 4th Symposium Core Research Cluster Materials Science & 3rd Symposium on International Joint Graduate Program in Materials Science, Tohoku University, online, Tohoku, Japan (2020)
773.
Talk
Lymperakis, L.: Νanomaterials from first principles. Department of Physics Colloquium, University of Crete, delivered online, Crete, Greece (2020)
774.
Talk
Lymperakis, L.: Properties and design of nanomaterials from first principles. Department of Physics Colloquium, University of Crete, delivered online, Crete, Greece (2020)
775.
Talk
Janßen, J.; Hickel, T.; Neugebauer, J.: pyiron – an integrated development environment for ab initio thermodynamics. AMS Seminar, virtual, Bochum, Germany (2020)
776.
Talk
Zhao, H.; Gault, B.; De Geuser, F.; Huber, L.; Lu, W.; Peter, N. J.; Ponge, D.; Raabe, D.: Segregation and precipitation at grain boundaries in an Al-Zn-Mg-Cu alloy. 17th International Conference on Aluminium Alloys ICAA 2020, virtual, Grenoble, France (accepted)
777.
Talk
Raabe, D.; Li, Z.; Ikeda, Y.; Dutta, B.; Körmann, F.; Neugebauer, J.: Thermodynamics and symmetry effects in high entropy alloys. Third International Conference on High Entropy Materials, Berlin, Germany (2020)
778.
Talk
Janßen, J.; Hickel, T.; Neugebauer, J.: Automated ab-initio Determination of Materials Properties at finite Temperatures with pyiron. NIST Workshop, virtual, Rockville, MD, USA (2020)
779.
Talk
Todorova, M.; Yoo, S.-H.; Surendralal, S.; Neugebauer, J.: Insights into the stability and reactivity of solid/liquid interfaces from ab initio calculations. 71st Annual Meeting of the International Society of Electrochemistry "Electrochemistry towards Excellence", virtual, Belgrade, Serbia (2020)
780.
Talk
Mendive-Tapia, E.: Ab initio origin of the short period magnetism of MnGe from thermally fluctuating local moments. Quantum Theory of Materials Seminar, virtual, Jülich, Germany (2020)
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