Publications of J. Neugebauer

Dutta, B.; Hickel, T.; Neugebauer, J.; Hütten, A.: Improving the magneto-caloric effect in layered alloys: An ab-initio investigation. DPG Frühjahrstagung 2013, Regensburg, Germany (2013)

Glensk, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Ab initio simulations of point defects put to the melting temperature. DPG-Frühjahrstagung 2013, Regensburg, Germany (2013)

Izanlou, A.; Todorova, M.; Friák, M.; Neugebauer, J.: Fe₃Al surfaces in dry and humid oxygen atmosphere. DPG Frühjahrstagung, Regensburg, Germany (2013)

Korbmacher, D.; Glensk, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Ab initio finite temperature description of α Ti including anharmonic contributions. DPG-Frühjahrstagung 2013, Regensburg, Germany (2013)

Körmann, F.; Grabowski, B.; Dutta, B.; Hickel, T.; Neugebauer, J.: First-Principles Thermodynamics of Paramagnetic Gama Fe. TMS Annual Meeting, San Antonio, TX, USA (2013)

Neugebauer, J.: Materials Design based on Predictive Ab Initio Thermodynamics. APS, Baltimore, MD, USA (2013)

Neugebauer, J.: Fully ab initio determination of free energies: Basis for high-throughput approaches in materials design. DPG Frühjahrstagung 2013, Regensburg, Germany (2013)

Ponge, D.; Millán, J.; Sandlöbes, S.; Choi, P.-P.; Hickel, T.; Kirchheim, R.; Neugebauer, J.; Raabe, D.: Bulk Combinatorial Design of nanostructured steels: From composition to mechanisms. DPG Spring Meeting 2013, Regensburg, Germany (2013)

Todorova, M.; Neugebauer, J.: Aligning electronic energy levels in electrochemical systems. DPG Frühjahrstagung, Regensburg, Germany (2013)

Todorova, M.; Neugebauer, J.: Extending the Concept of Semiconductor Defect Chemistry to Electrochemistry. TMS Annual Meeting, San Antonio, TX, USA (2013)

Neugebauer, J.: Understanding and overcoming doping limits in GaN. SPIE Photonics West 2013, San Francisco, CA, USA (2013)

Bleskov, I.; Hickel, T.; Neugebauer, J.: Impact of Local Magnetism on Planar Defects in Pure Iron. SFB-761 Annual Meeting 2013, Herdecke, Germany (2013)

Bleskov, I.; Körmann, F.; Hickel, T.; Neugebauer, J.: Impact of Magnetism on Thermodynamic Properties of Iron. International Symposium “Frontiers In Electronic Structure Theory And Multi Scale Modeling” (FEST-VEK), Moscow, Russia (2013)

Fabritius, H.-O.; Nikolov, S.; Janus, A. M.; Eisenlohr, P.; Friák, M.; Neugebauer, J.; Raabe, D.: Comparison of the mechanical behavior of exoskeletal parts from different Crustacea – Experiments and Modeling. MRS Fall Meeting 2013, Boston, MA, USA (2013)

Freysoldt, C.; Pfanner, G.; Neugebauer, J.: Defects in amorphous silicon from H insertion. Workshop "Spins as Functional Probes in Solar Energy Research", Berlin, Germany (2013)

Friák, M.; Titrian, H.; Aydin, U.; Raabe, D.; Neugebauer, J.: Self-consistent scale-bridging approach to compute the elasticity of multi-phase polycrystals. DPG Frühjahrstagung, Regensburg, Germany (2013)

Hemzalová, P.; Friák, M.; Šob, M.; Udyanksy, A.; Ma, D.; Neugebauer, J.: Ab initio study of thermodynamic, electronic, magnetic, structural, and elastic properties of Ni₄N allotropes. DPG Frühjahrstagung, Regensburg, Germany (2013)

Neugebauer, J.: Smart microstructures by non-ergodic martensitic transitions. Non-ergodic behavior in martensites, Universität Duisburg-Essen, Duisburg, Germany (2013)

Neugebauer, J.: Ab initio guided materials design: Application to doping and growth of group-III nitride. Colloquium, TH Ilmenau, Ilmenau, Germany (2013)

Neugebauer, J.: Modeling steels exhibiting unconventional deformation mechanisms based on ab initio based multiscale simulations. Kolloquium TH Ilmenau, Ilmenau, Germany (2013)