Publications of J. Neugebauer

Counts, W. A.; Friák, M.; Raabe, D.; Neugebauer, J.: Using Ab Initio to Predict Engineering Parameters in bcc Magnesium-Lithium Alloys. American Physics Society March Meeting, New Orleans, LA, USA (2008)

Counts, W. A.; Friák, M.; Raabe, D.; Neugebauer, J.: Using DFT to Predict Mechanical Properties of MgLi Alloys. DPG Meeting, Berlin, Germany (2008)

Abu-Farsakh, H.; Neugebauer, J.: Enhancing N solubility in diluted nitrides by surface kinetics: An ab-initio study. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Freysoldt, C.; Neugebauer, J.: Charged defects in a supercell formalism: From an empirical to a fully ab-initio treatment of finite-size effects. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Grabowski, B.; Ismer, L.; Hickel, T.; Neugebauer, J.: Ab initio up to the melting point: Influence of vacancies and explicit anharmonicity. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Kim, O.; Friák, M.; Neugebauer, J.: Ab initio analysis of the carbon solubility limits in various iron phases. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Lymperakis, L.; Neugebauer, J.: Thermodynamics and adatom kinetics of non-polar GaN surfaces. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Marquardt, O.; Hickel, T.; Neugebauer, J.: Plane-wave implementation of the k.p-formalism including strain and piezoelectricity to study the optical properties of semiconductor nanostructures. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Petrov, M.; Friák, M.; Lymperakis, L.; Raabe, D.; Neugebauer, J.: An ab-initio study of the hydrogen-bond network in crystalline alpha-chitin. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Todorova, M.; Neugebauer, J.: A new approach to obtain electrochemical E/pH diagrams derived from the viewpoint of semiconductor defects. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Udyansky, A.; Friák, M.; Neugebauer, J.: An ab-initio study of the phase transitions in the interstitial Fe–C solid solutions. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Uijttewaal, M.; Hickel, T.; Neugebauer, J.: Phase transformations of Ni₂MnGa shape memory alloy from first principles. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

von Pezold, J.; Neugebauer, J.: Hydrogen enhanced local plasticity - An atomistic study. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Neugebauer, J.: Ab initio design of engineering materials: Status and challenges. UCSB-MPG Workshop on Inorganic Materials for Energy Conversion, Storage and Conservation, UCLA Lake Arrowhead Conference Center, CA, USA (2008)

Neugebauer, J.: Ab initio based modeling of engineering materials: From a predictive thermodynamic description to tailored mechanical properties. UCSB Seminar, University of California, Santa Barbara, USA (2008)

Hickel, T.; Uijttewaal, M.; Grabowski, B.; Neugebauer, J.: First principles Determination of Phase Transitions in Magnetic Shape Memory Alloys. Group Seminar in Materials Department, University of California (UCSB), Santa Barbara, CA, USA (2008)

Counts, W. A.; Friák, M.; Raabe, D.; Neugebauer, J.: Using Ab Initio to Predict Engineering Parameters in bcc Magnesium-Lithium Alloys. Deutsche Physikalische Gesellschaft Meeting, Berlin, Germany (2008)

Friák, M.; Sander, B.; Ma, D.; Raabe, D.; Neugebauer, J.: First-principle study of materials properties in metallic alloys. German-Korean miniworkshop, MPI für Eisenforschung GmbH, Düsseldorf, Germany (2008)

Hickel, T.; Grabowski, B.; Körmann, F.; Dick, A.; Neugebauer, J.: Ab intio determination of free energies and phase diagrams. German-Korean miniworkshop, MPI für Eisenforschung GmbH, Düsseldorf, Germany (2008)

von Pezold, J.; Neugebauer, J.: Molecular Dynamics simulation of dislocations in metals. German-Korean miniworkshop, MPI für Eisenforschung GmbH, Düsseldorf, Germany (2008)