Talk (1232)

1061.
Talk
Neugebauer, J.: A brief introduction to surface science from a modelers perspective. Colloquium at Ecole Polytechnique, Paris, France (2015)
1062.
Talk
Neugebauer, J.: Introduction to density functional Theory from a materials science perspective. ICAMS course “Multiscale Modelling”, Bochum, Germany (2015)
1063.
Talk
Dey, P.; Nazarov, R.; Yao, M.; Friák, M.; Hickel, T.; Neugebauer, J.: Adaptive C content in coherently strained kappa-carbides - An ab initio explanation of atom probe tomography data. 2nd German-Austrian Workshop on "Computational Materials Science on Complex Energy Landscapes", Kirchdorf, Austria (2015)
1064.
Talk
Dutta, B.; Körmann, F.; Hickel, T.; Neugebauer, J.: The itinerant coherent potential approximation for phonons: Role of fluctuations for systems with magnetic disorder. 2nd German-Austrian Workshop, Kirchdorf, Austria (2015)
1065.
Talk
Gupta, A.; Dutta, B.; Hickel, T.; Neugebauer, J.: Thermodynamic phase stability in the Al–Sc system using first principles methods. 2nd German-Austrian Workshop on "Computational Materials Science on Complex Energy Landscapes", Kirchdorf, Austria (2015)
1066.
Talk
Hickel, T.; Nazarov, R.; McEniry, E.; Dey, P.; Neugebauer, J.: Ab initio insights into the interaction of hydrogen with precipitates in steels. Workshop on Hydrogen Embrittlement and Sour Gas Corrosion 2015, Düsseldorf, Germany (2015)
1067.
Talk
Korbmacher, D.; Glensk, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.; Duff, A.; Finnis, M. W.: Ab initio description of the Ti bcc to omega transition at finite temperatures. PTM 2015, International Conference on Solid-Solid Phase Transformations in Inorganic Materials, Whistler, BC, Canada (2015)
1068.
Talk
Körmann, F.; Grabowski, B.; Dutta, B.; Hickel, T.; Neugebauer, J.: Temperature dependent magnon-phonon coupling. 2nd German-Austrian Workshop, Kirchdorf, Austria (2015)
1069.
Talk
Neugebauer, J.: Ab Initio Thermodynamics: A Novel Route to Design Structural Materials with Superior Mechanical Properties. TMS-MEMA Conference, Doha, Katar (2015)
1070.
Talk
Neugebauer, J.: Big Data im computergestützten Materialdesign. CPTS Big Data round table, Tübingen, Germany (2015)
1071.
Talk
Neugebauer, J.: Design and discovery of structural materials on the computer: Prospects and challenges. Colloquium at Universität Magdeburg, Magdeburg, Germany (2015)
1072.
Talk
Neugebauer, J.: Ab initio description of finite temperature phase stabilities and transformations. PTM Conference, Whistler, BC, Canada (2015)
1073.
Talk
Neugebauer, J.: Ab initio computation of free energies up to the melting point: Status and challenges. Symposium in Uppsala, Uppsala, Sweden (2015)
1074.
Talk
Vatti, A. K.; Todorova, M.; Neugebauer, J.: Formation Energy of ions in water: An ab initio molecular dynamics study. 2nd German-Austrian Workshop on "Computational Materials Science on Complex Energy Landscapes", Kirchdorf, Austria (2015)
1075.
Talk
Zendegani, A.; Körmann, F.; Hickel, T.; Hallstedt, B.; Neugebauer, J.: First-principles study of thermodynamic properties of the Q phase in Al–Cu–Mg–Si. Calphad XLIV, Loano, Italy (2015)
1076.
Talk
Zendegani, A.; Körmann, F.; Hickel, T.; Neugebauer, J.: First-principles study of thermodynamic properties of the Q-phase in Al–Cu–Mg–Si. 2nd German-Austrian Workshop, Kirchdorf, Austria (2015)
1077.
Talk
Zhang, X.; Hickel, T.; Rogal, J.; Drautz, R.; Neugebauer, J.: Atomistic origin of structural modulations in Fe ultrathin films on Cu(001). 2nd German-Austrian Workshop, Kirchdorf, Austria (2015)
1078.
Talk
Hickel, T.: Understanding complex materials at finite temperatures by ab inito methods. Colloquium at Institut für Materialwissenschaft, Universtität Stuttgart, Stuttgart, Germany (2014)
1079.
Talk
Todorova, M.: Stability and defect chemistry of zinc oxide in contact with an electrochemical environment: An ab initio approach. Helmholtz-Zentrum Berlin , Berlin, Germany (2014)
1080.
Talk
Fabritius, H.-O.; Janus, A. M.; Wu, X.; Nikolov, S.; Eisenlohr, P.; Friák, M.; Neugebauer, J.; Raabe, D.: Structure-property Relations in the Arthropod Exoskeleton, a Multifunctional Biological Composite. Materials Science & Technology (MS&T) 2014, Pittsburgh, PA, USA (2014)
Go to Editor View