Vortrag (57)

81.
Vortrag
Neugebauer, J.: Hydrogen embrittlement research at the MPIE (Max-Planck-Institut für Eisenforschung). SNEAC Workshop Environmental Assisted Cracking, Trondheim, Norway (2016)
82.
Vortrag
Gault, B.; Herbig, M.; Liebscher, C.; Kuzmina, M.; Dehm, G.; Mayer , J.; Ponge, D.; Scheu, C.; Stoffers, A.; Sandlöbes, S. et al.; Neugebauer, J.; Raabe, D.: Defect Segregation studied by Correlative Atom Probe Tomography and Electron Microscopy. Japan-Germany Joint Symposium on Advanced Characterization of Nanostructured Materials for Energy and Environment, Conference Center Mutterhaus, Düsseldorf, Germany (2016)
83.
Vortrag
Dutta, B.; Hickel, T.; Neugebauer, J.: Phase diagrams in magnetic shape memory alloys: Insights obtained from ab initio thermodynamics. The forty-fifth International Conference on Computer Coupling of Phase Diagrams and Thermochemistry, Awaji Island, Hyogo, Japan (2016)
84.
Vortrag
Neugebauer, J.: Ab initio determination of lattice stabilities and comparison to CALPHAD. Plenary talk, CALPHAD XLV Conference, Awaji Island, Japan (2016)
85.
Vortrag
Grabowski, B.: Entwicklung von quantenmechanischen Simulationsmethoden für das Design moderner metallischer Werkstoffe. Seminar at University Paderborn, Paderborn, Germany (2016)
86.
Vortrag
Todorova, M.: Elementary reaction steps in electrocatalysis: Theory meets experiment. Workshop 2016 der DFG-Forschergruppe 1376 , Reisensburg, Günzburg, Germany (2016)
87.
Vortrag
Dey, P.; Nazarov, R.; Dutta, B.; Yao, M.; Herbig, M.; Friák, M.; Hickel, T.; Raabe, D.; Neugebauer, J.: An ab-initio prediction of the off-stoichiometry of Fe–Mn–Al–C κ carbides. CALPHAD XLV, Awaji Island, Hyogo, Japan (2016)
88.
Vortrag
Grabowski, B.: Entwicklung von quantenmechanischen Simulationsmethoden für das Design moderner metallischer Werkstoffe. Seminar at Universität Paderborn, Paderborn, Germany (2016)
89.
Vortrag
Todorova, M.: Oxide stability and defect chemistry in an electrochemical environment: an ab initio perspective. Workshop 2016 der DFG-Forschergruppe 1376 “Elementary reaction steps in electrocatalysis: Theory meets experiment“, Reisensburg, Günzburg, Germany (2016)
90.
Vortrag
Neugebauer, J.: Database concepts and ICME links for atomistic simulations. Plenary talk, 2nd International Workshop on Software Solutions for Integrated Computational Materials Engineering ICME 2016, Barcelona, Spain (2016)
91.
Vortrag
Surendralal, S.; Todorova, M.; Neugebauer, J.: Automated calculations for charged point defects in MgO and α-Fe2O3. DPG-Frühjahrstagung 2016, Regensburg, Germany (2016)
92.
Vortrag
Grabowski, B.: Modern materials design from first-principles: Recent progress and future prospects. DPG Jahrestagung Regensburg, Regensburg, Germany (2016)
93.
Vortrag
Dutta, B.; Debashish, D.; Ghosh, S.; Sanyal, B.; Hickel, T.; Neugebauer, J.: Intricacies of phonon line shapes in random alloys: A first-principles study. DPG Spring Meeting of the Condensed Matter Section, Regensburg, Germany (2016)
94.
Vortrag
Dey, P.; Nazarov, R.; Dutta, B.; Yao, M.; Herbig, M.; Friák, M.; Hickel, T.; Raabe, D.; Neugebauer, J.: Origin of the off-stoichiometry of Fe–Mn–Al–C κ carbides: An ab-initio explanation of atom probe tomography data. DPG 2016, Regensburg, Germany (2016)
95.
Vortrag
Dutta, B.; Begum, V.; Hickel, T.; Neugebauer, J.: Impact of point defects on the phase stability in Heusler alloys: A first-principles study. DPG Spring Meeting of the Condensed Matter Section, Regensburg, Germany (2016)
96.
Vortrag
Vatti, A. K.; Todorova, M.; Neugebauer, J.: Ab initio Determination of Formation Energies and Charge Transfer Levels of Charged Ions in Water. APS 2016, Baltimore, MD, USA (2016)
97.
Vortrag
Vatti, A. K.; Todorova, M.; Neugebauer, J.: Formation Energy of Ions in Water using ab-initio Molecular Dynamics. DPG Frühjahrstagung 2016, Regensburg, Germany (2016)
98.
Vortrag
Zendegani, A.; Körmann, F.; Hickel, T.; Hallstedt, B.; Neugebauer, J.: Heat capacity of the quaternary Q phase in Al–Cu–Mg–Si: A combined ab-initio, phonon and compound energy formalism approach. DPG-Frühjahrstagung 2016, Regensburg, Germany (2016)
99.
Vortrag
Neugebauer, J.: The digital transformation in Materials Science from a Modellers Perspective. VDI Workshop „Digitale Transformation in der Werkstofftechnik”, Düsseldorf, Germany (2016)
100.
Vortrag
Körmann, F.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Lattice excitations in magnetic alloys: Recent advances in ab initio modeling of coupled spin and atomic fluctuations. TMS Annual Meeting 2016, Nashville, TN, USA (2016)
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