Publications of J. Neugebauer

Dutta, B.; Hickel, T.; Neugebauer, J.; Hütten, A.: Ab-initio investigation of layered alloys: a roadmap for improved magneto-caloric effect. EUROMAT 2013, Sevilla, Spain (2013)

Sandlöbes, S.; Wang, F.; Friák, M.; Raabe, D.; Pei, Z.; Zhu, L.-F.; Zaefferer, S.; Neugebauer, J.: Design of ductile Mg alloys by combining ab initio and experimental methods. Euromat 2013, Sevilla, Spain (2013)

Duff, A.; Lymperakis, L.; Neugebauer, J.: Limits of Indium Incorporation on In1-xGaxN {0001} III- and N-Polar Surfaces: An Ab Initio Approach. 10th International Conference on Nitride Semiconductors, Washigton DC, USA (2013)

Chen, L.; Zhu, L.-F.; Friák, M.; Ma, D.; Race, C. P.; Bhogireddy, V. S. P. K.; Spatschek, R.; Svendsen, B.; Raabe, D.; Neugebauer, J.: Atomistic and inverse-analytical modeling of elastic properties of coherent nano-phases. GDRi CNRS MECANO General Meeting on the Mechanics of Nano-Objects, MPIE, Düsseldorf, Germany (2013)

Dutta, B.; Hickel, T.; Neugebauer, J.: Ab-initio based prediction of chemical trends for phase transitions in magnetic shape memory alloys. Computation meets Experiment: KKR Green functions for calculations of spectroscopic, transport and magnetic properties, Department of Physics, University of Warwick, Warwick, Coventry, UK (2013)

Todorova, M.; Neugebauer, J.: Electrochemical Pourbaix phase diagrams from ab initio calculations. XLII CALPHAD Conference, San Sebastian, Spain (2013)

Cheng, S.-T.; Todorova, M.; Neugebauer, J.: Interactions of oxidizing species with the Mg(0001) surface: The role of electrostatic contributions. Connecting electrochemical and water simulations: Status and future challenges, Ringberg, Germany (2013)

Todorova, M.; Neugebauer, J.: Extending the concept of semiconductor defect chemistry to electrochemistry. Connecting electrochemical and water simulations: Status and future challenges, Ringberg, Germany (2013)

Bleskov, I.; Sandlöbes, S.; Hickel, T.; Neugebauer, J.: Stacking Faults in fcc Iron: The Influence of Magnetism. DPG spring meeting 2013, Regensburg, Germany (2013)

Todorova, M.; Neugebauer, J.: Extending the concept of semiconductor defect chemistry to electrochemistry. Workshop "Connecting electrochemical and water simulations: Status and future challenges", San Sebastian, Spain (2013)

Nematollahi, A.; von Pezold, J.; Neugebauer, J.; Raabe, D.: Carbon diffusion path around edge dislocation in bcc iron. 10th Materials Day, Bochum, Germany (2012)

Remmele, T.; Schulz, T.; Markurt, T.; Korytov, M.; Albrecht, M.; Duff, A.; Lymperakis, L.; Neugebauer, J.: Quantitative measurement of composition fluctuations in InGaN quantum wells. 15th European Microscopy Congress, Manchester Central, UK (2012)

Haghighat, S. M. H.; von Pezold, J.; Neugebauer, J.; Raabe, D.: Mobility of the ½ a₀<111> screw dislocation in iron under different loading conditions. 4th International Conference on Dislocations, Budapest, Hungary (2012)

Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Atomic forces at finite magnetic temperatures: Phonons in paramagnetic iron. Calphad XLI, Berkely, CA, USA (2012)

Kalesaki, E.; Kioseoglou, J.; Lymperakis, L.; Neugebauer, J.; Karakostas, T.; Komninou, P.: Semipolar {11-22} AlN surfaces: Morphology and electronic properties. International Conference on Extended Defects in Semiconductors, Thessaloniki, Greek (2012)

Aydin, U.; Hickel, T.; Neugebauer, J.: Combining ab initio with data mining techniques: Solution enthalpy of hydrogen in transition metals. ADIS Conference 2012, Ringberg, Germany (2012)

Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Atomic forces at finite magnetic temperatures: Phonons in paramagnetic iron. ADIS Conference 2012, Ringberg, Germany (2012)

Aydin, U.; Hickel, T.; Neugebauer, J.: Combining ab initio with data mining techniques: Solution enthalpy of hydrogen in transition metals. DPG Frühjahrstagung 2012, Berlin, Germany (2012)

Bauer, K.-D.; Todorova, M.; Hingerl, K.; Neugebauer, J.: Ab-initio Study on Liquid Metal Embrittlement in the Fe/Zn System. International Workshop on Ab initio Description of Iron and Steel (ADIS2012), Ringberg, Germany (2012)

Bleskov, I.; Abbasi, A.; Dick, A.; Hickel, T.; Neugebauer, J.: Ab initio investigation of the stacking fault in Fe-based alloys. ADIS 2012: Ab initio Description of Iron and Steel, Ringberg, Germany (2012)