Talk (1232)

1841.
Talk
Neugebauer, J.: Ab initio Multiskalensimulationen zum Wachstum und zur Defektstruktur von Gruppe-III-Nitriden. Kolloquium, Universität Bochum (2005)
1842.
Talk
Neugebauer, J.: Ab initio Simulations of Solid State Processes. Geomat-Konferenz, Aachen, Germany (2005)
1843.
Talk
Grabowski, B.: Ab initio based free energy surfaces: A tool to derive temperature dependent thermodynamic and kinetic parameters. DPG-Jahrestagung, Berlin, Germany (2005)
1844.
Talk
Ismer, L.; Ireta, J.; Neugebauer, J.; Scheffler, M.: A DFT-GGA based thermodynamic analysis of the secondary structure of proteins. DPG-Jahrestagung, Berlin, Germany (2005)
1845.
Talk
Wahn, M.; Neugebauer, J.: Generalized Wannier functions: An accurate and efficient way to construct ab-initio tight-binding orbitals. DPG-Tagung, Berlin, Germany (2005)
1846.
Talk
Lymperakis, L.; Neugebauer, J.: Formation of steps and vicinal surfaces on GaN (0001) surfaces: Implications on surface morphologies and surface roughening. DPG spring meeting, Berlin, Germany (2005)
1847.
Talk
Neugebauer, J.: Computergestütztes Materialdesign mittels ab initio Multiskalenmethoden. Kolloquium IWF, Dresden, Germany (2005)
1848.
Talk
Neugebauer, J.: Ab initio Multiskalensimulationen zu Defekten und zum Wachstum von breitlückigen Halbleitern. SiC-Kolloquium, Universität Erlangen-Nürnberg (2005)

Conference Report (1)

1849.
Conference Report
Ferraz Morgado, F.; Bhatt, S.; Stephenson, L.; Mouton, I.; Neugebauer, J.; Raabe, D.; Freysoldt, C.; Gault, B.; Katnagallu, S.: Role of Simulations and Experiments in Analytical Field Ion Microscopy. Microscopy and Microanalysis 29 (Supplement_1), p. 602 (2023)

Poster (191)

1850.
Poster
Meier de Andrade, A.; Bitzek, E.: Fracture in the Presence of Hydrogen - Influence of the Potential. The 11th International Conference on Multiscale Materials Modeling, Prague, Czech Republic (2024)
1851.
Poster
Meier de Andrade, A.; Bitzek, E.: Fracture in the Presence of Hydrogen - Influence of the Potential. The XXII Brazilian Materials Research Society (B-MRS) Meeting 2024, Santos, Brazil (2024)
1852.
Poster
Schwarz, T.; Yang, J.; Aota, L. S.; Woods, E.; Zhou, X.; Neugebauer, J.; Todorova, M.; McCaroll, I.; Gault, B.: Analysis of the reactive solid-liquid interface during the corrosion of magnesium at the near atomic level using cryo-atom probe tomography. Aqueous Corrosion Gordon Research Conference (GRC) 2024, Corrosion Challenges and Opportunities for the Energy Transition, New London, CT, USA (2024)
1853.
Poster
Schwarz, T.; Yang, J.; Aota, L. S.; Woods, E.; Zhou, X.; Neugebauer, J.; Todorova, M.; McCaroll, I.; Gault, B.: Analysis of the reactive solid-liquid interface during the corrosion of magnesium at the near atomic level using cryo-atom probe tomography. Aqueous Corrosion Gordon Research Seminar (GRS) 2024, Corrosion Monitoring, Modelling and Mitigation Towards a Sustainable Future, New London, CT, USA (2024)
1854.
Poster
Zhu, L.-F.; Neugebauer, J.; Grabowski, B.: A computationally highly efficient ab initio approach for melting property calculations and practical applications. CALPHAD 2024, Mannheim, Germany (2024)
1855.
Poster
Zhu, L.-F.: Towards high throughput melting property calculations with ab initio accuracy aided by machine learning potential and pyiron workflow. New Horizons in materials design at MPIE, Düsseldorf, Germany (2023)
1856.
Poster
Bitzek, E.; Smrinova, D.: Atomistic Modelling of Dislocation – Vacancy Interactions and Dislocation Climb. Colloque Plasticité 2023, Lyon, France (2023)
1857.
Poster
Bajaj, P.; Kürnsteiner, P.; Gupta, A.; Wilms, M. B.; Hickel, T.; Weisheit, A.; Jägle, E. A.; Raabe, D.: Intrinsic Heat Treatment in Al–Sc Alloys During Laser Metal Deposition - Driving Factors, Kinetics and Effect of Impurities. Alloys for Additive Manufacturing Symposium 2019 (AAMS2019), Chalmers University of Technology, Gothenburg, Sweden (2019)
1858.
Poster
Zendegani, A.; Šlapáková Poková, M.; Liebscher, C.; Stein, F.; Kumar, K. S.; Hammerschmidt, T.; Hickel, T.; Neugebauer, J.: Relative stability of stacking faults in Fe–Nb alloys in comparison with the convex hull for bulk phases. CALPHAD XLVIII, Singapore, Singapore (2019)
1859.
Poster
Rao, Z.; Ponge, D.; Körmann, F.; Ikeda, Y.; Schneeweiss, O.; Friák, M.; Neugebauer, J.; Raabe, D.; Li, Z.: Invar effects in FeNiCo medium entropy alloys: from an invar treasure map to alloy design. DPG Regensburg 2019, Regensburg, Germany (2019)
1860.
Poster
Peter, N. J.; Frolov, T.; Duarte, M. J.; Hadian, R.; Ophus, C.; Kirchlechner, C.; Dehm, G.: Ag segregation induced nano-facet formation at an asymmetric Cu grain boundary. Young Materials Researcher Day YMRD , Karlsruhe, Germany (2018)
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