Publications

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Talk (843)

  1. 281.
    Talk
    Neugebauer, J.: First-principles approaches for charged defects in low dimensional systems. Conference on Physics of Defects in Solids, Trieste, Italy (2018)
  2. 282.
    Talk
    Neugebauer, J.: Understanding fundamental doping and stoichiometry limits in semiconductors by ab initio modelling. EDS 2018 Conference, Thessaloniki, Greece (2018)
  3. 283.
    Talk
    Zhu, L.-F.; Grabowski, B.; Neugebauer, J.: Efficient approach to compute melting properties fully from ab initio with application to Cu. CALPHAD XLVII Conference, Querétaro, México (2018)
  4. 284.
    Talk
    Neugebauer, J.: From electrons to the design of structurally complex materials. SFB ViCoM conference EPT 2018: From electrons to phase transitions, Vienna, Austria (2018)
  5. 285.
    Talk
    Neugebauer, J.: Exploration of Large Ab Initio Data Spaces to Design Structural Materials with Superior Mechanical Properties. Hume-Rothery Award Symposium, TMS 2018, Phoenix, AZ, USA (2018)
  6. 286.
    Talk
    Zendegani, A.; Šlapáková Poková, M.; Liebscher, C.; Stein, F.; Ladines, A. N. C.; Hammerschmidt, T.; Drautz, R.; Körmann, F.; Hickel, T.; Neugebauer, J.: Energetics of non-stoichiometric stacking faults in Fe-Nb alloys: An ab initio study. DPG-Frühjahrstagung 2018, Berlin, Germany (2018)
  7. 287.
    Talk
    Neugebauer, J.: Understanding the fundamental mechanisms behind H embrittlement: An ab initio guided multiscale approach. Seminar E2M ("Wall Forum") at MPI for Plasma Physics, Garching, Germany (2018)
  8. 288.
    Talk
    Neugebauer, J.: A first principles approach to model electrochemical reactions in an electrolytic cell. Workshop: The Electrode Potential in Electrochemistry - A Challenge for Electronic Structure Theory Calculations, Schloß Reisensburg, Günzburg, Germany (2017)
  9. 289.
    Talk
    Dutta, B.; Körmann, F.; Hickel, T.; Neugebauer, J.: Temperature-driven effects in functional materials: Ab initio insights. Talk at University Pierre and Marie CURIE (UPMC), Paris, France (2017)
  10. 290.
    Talk
    Neugebauer, J.: Free energy sampling strategies for structurally complex materials. Workshop II: Stochastic Sampling and Accelerated Time Dynamics on Multidimensional Surfaces, IPAM, UCLA, Los Angeles, CA, USA (2017)
  11. 291.
    Talk
    Neugebauer, J.: Materials Discovery and Design at Finite Temperatures. MS&T 2017, Pittsburgh, PA, USA (2017)
  12. 292.
    Talk
    Neugebauer, J.: Materials Discovery and Design on Grain Boundary Migration. MS&T, Pittsburgh, PN, USA (2017)
  13. 293.
    Talk
    Friák, M.; Holec, D.; Jirásková, Y.; Palm, M.; Stein, F.; Janičkovič, D.; Pizúrová, N.; Dymáček, P.; Dobeš, F.; Šesták, P. et al.; Fikar, J.; Šremr, J.; Boutur, D.; Nechvátal, L.; Pavlů, J.; Oweisová, S.; Homola, V.; Titov, A.; Miháliková, I.; Slávik, A.; Buršíková, V.; Neugebauer, J.; Šob, M.: Theory-guided Design of Novel Fe–Al-based Superalloys. Intermetallics 2017, Educational Center Kloster Banz, Bad Staffelstein, Germany (2017)
  14. 294.
    Talk
    Zendegani, A.; Šlapáková Poková, M.; Liebscher, C.; Stein, F.; Ladines, A. N. C.; Hammerschmidt, T.; Drautz, R.; Körmann, F.; Hickel, T.; Neugebauer, J.: Impact of Magnetism on the Stability of Topologically Close-packed (TCP) Phases in Fe–Nb Alloys. Intermetallics 2017, Educational Center Kloster Banz, Bad Staffelstein, Germany (2017)
  15. 295.
    Talk
    Neugebauer, J.: Modelling structural materials in realistic environments by ab initio thermodynamics. EUROMAT 2017, Thessaloniki, Greece (2017)
  16. 296.
    Talk
    Dutta, B.; Olsen, R. J.; Mu, S.; Hickel, T.; Samolyuk, G. D.; Specht, E. D.; Bei, H.; Lindsay, L. R.; Neugebauer, J.; Stocks , M. et al.; Larson, B. C.: Lattice dynamics in high entropy alloys: understanding the role of fluctuations. EUROMAT 2017, Thessaloniki, Greece (2017)
  17. 297.
    Talk
    Dutta, B.; Körmann, F.; Hickel, T.; Neugebauer, J.: Impact of magnetic fluctuations on phonons: a Green's function-based approach. MPIE-ICAMS workshop, Ebernburg, Germany (2017)
  18. 298.
    Talk
    Zhu, L.-F.; Grabowski, B.; Neugebauer, J.: Efficient approach to compute melting properties fully from ab initio with application to Cu. MPIE-ICAMS workshop, Ebernburg, Germany (2017)
  19. 299.
    Talk
    Dey, P.; Yao, M.; Friák, M.; Hickel, T.; Raabe, D.; Neugebauer, J.: Ab-initio investigation of the role of kappa carbide in upgrading Fe–Mn–Al–C alloy to the class of advanced high-strength steels. ArcelorMittal Global R&D Gent, Thessaloniki, Greece (2017)
  20. 300.
    Talk
    Ponge, D.; Tasan, C. C.; Springer, H.; Gutiérrez-Urrutia, I.; Koyama, M.; Kuzmina, M.; Wang, M.; Morsdorf, L.; Gault, B.; Seol, J. B. et al.; Choi, P.-P.; Liebscher, C.; Yao, M.; Li, Z.; Wang, H., H.; Neugebauer, J.; Scheu, C.; Raabe, D.: 1 Billion Tons of Nanostructure - Metastability Alloy Design and Segregation Engineering. 38th Risø Intern. Symp. Materials Science Advanced Metallic Materials by Microstructural Design , Roskilde, Denmark (2017)
 
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