Vortrag (1226)

1441.
Vortrag
Aydin, U.; Ismer, L.; Hickel, T.; Neugebauer, J.: Chemical trends of the solution enthalpy of hydrogen in 3d transition metals in dilute limit, derived from first principles. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1442.
Vortrag
Grabowski, B.; Ismer, L.; Hickel, T.; Neugebauer, J.: Computing Ab Initio Free Energy Contributions of Point Defects. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1443.
Vortrag
Hickel, T.: Computational Phase Studies: Deriving thermodynamic properties of metals from first principles. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1444.
Vortrag
Kim, O.; Friák, M.; Neugebauer, J.: Ab initio analysis of the carbon solubility limits in various iron allotropes. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1445.
Vortrag
Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Ab initio determination of the magnetic free energy contribution of metallic systems. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1446.
Vortrag
Lange, B.; Freysoldt, C.; Neugebauer, J.: Constructing fully numerical, quantitatively optimized atomic orbitals basis-sets. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1447.
Vortrag
Liot, F.; Friák, M.; Hickel, T.; Neugebauer, J.: Spin-polarization-induced structural selectivity in substituted Laves phases. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1448.
Vortrag
Liot, F.; Hooley, C.: Thermal expansion anomaly in iron-based ferromagnets: The relation to magnetism. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1449.
Vortrag
Lymperakis, L.; Neugebauer, J.: Ab initio Based Growth Simulations of III-Nitride nanowires. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1450.
Vortrag
Nazarov, R.; Hickel, T.; Neugebauer, J.: First-principles and thermodynamic description of hydrogen interaction with vacancies in fcc iron. DPG 2010 Meeting, Regensburg, Germany (2010)
1451.
Vortrag
Pfanner, G.; Freysoldt, C.; Neugebauer, J.: A theoretical study of hyperfine parameters in amorphous silicon. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1452.
Vortrag
Tillack, N.; Hickel, T.; Raabe, D.; Neugebauer, J.: Ab initio studies of nano-precipitation and growth in ferritic steels. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1453.
Vortrag
Todorova, M.; Valtiner, M.; Grundmeier, G.; Neugebauer, J.: Temperature stabilised surface reconstructions at polar ZnO(0001). DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1454.
Vortrag
Udyansky, A.; von Pezold, J.; Dick, A.; Neugebauer, J.: Multi-scale study of martensite stability in Fe-based solid solutions. DPG spring meeting, Regensburg, Germany (2010)
1455.
Vortrag
von Pezold, J.; Aydin, U.; Hickel, T.; Neugebauer, J.: Strain-induced metal-hydrogen interactions across the 1st transition series: An ab initio study of hydrogen embrittlement. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1456.
Vortrag
von Pezold, J.; Friák, M.; Neugebauer, J.: Atomic-scale quantification of solution hardening mechanisms. DPG Frühjahrstagung 2010, Regensburg, Germany (2010)
1457.
Vortrag
Zhu, L.-F.; Dick, A.; Friák, M.; Hickel, T.; Neugebauer, J.: First principles study of thermodynamic, structural and elastic properties of eutectic Ti-Fe alloys. DPG Spring Meeting 2010, Regensburg, Germany (2010)
1458.
Vortrag
Bugaev, V.; Udyansky, A.; Wochner, P.; Dosch, H.: Reciprocal-Space Approach for Atomic Interactions and Configuration Correlations in Highly Inhomogeneous Systems. APS march meeting, Portland, OR, USA (2010)
1459.
Vortrag
Dick, A.; Hickel, T.; Neugebauer, J.: Structure and Energetics of the Stacking Faults in Austenitic FeMn Alloys Studied by First Principles Calculations. APS March Meeting 2010, Portland, OR, USA (2010)
1460.
Vortrag
Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Ab initio determination of the magnetic free energy contribution of metallic systems. APS March Meeting 2010, Portland, OR, USA (2010)
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