Publications of J. Neugebauer

Neugebauer, J.: Materials Design based on Predictive Ab Initio Thermodynamics. German-Sino-Workshop, Shenyang, China (2013)

Raabe, D.; Li, Y.; Ponge, D.; Sandlöbes, S.; Choi, P.; Hickel, T.; Kirchheim, R.; Neugebauer, J.: Transformations in Steels. German-Chinese High-level Workshop on “Microstructure-driven Design and Performance of Advanced Metals”, Institute of Metals Research (IMR) of the Chinese Academy of Science (CAS), Shenyang, China (2013)

Raabe, D.; Li, Y.; Ponge, D.; Sandlöbes, S.; Choi, P.-P.; Hickel, T.; Kirchheim, R.; Neugebauer, J.: Nanoscale Transformations in Steels. German-Chinese High-level Workshop on “Microstructure-driven Design and Performance of Advanced Metals”, Institute of Metals Research (IMR) of the Chinese Academy of Science (CAS), Shenyang, China (2013)

Körmann, F.; Grabowski, B.; Dutta, B.; Hickel, T.; Neugebauer, J.: First-principles thermodynamics of paramagnetic fcc iron. DPG Frühjahrstagung 2013, Regensburg, Germany (2013)

Chakrabarty, A.; von Pezold, J.; Spatschek, R.; Hickel, T.; Neugebauer, J.: First-principles calculations of the key atomistic parameters related to hydrogen embrittlement in FeMn. DPG Frühjahrstagung 2013, Regensburg, Germany (2013)

Cheng, S.-T.; Todorova, M.; Neugebauer, J.: Interactions of oxidizing species with the Mg(0001) surface: The role of electrostatic contributions. DPG Frühjahrstagung, Regensburg, Germany (2013)

Dey, P.; Nazarov, R.; Friák, M.; Hickel, T.; Neugebauer, J.: Ab initio study of kappa-carbides as precipitates in austenitic Fe matrix. DPG Frühjahrstagung 2013, Regensburg, Germany (2013)

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)