Talk (1232)
841.
Talk
Modelling structural materials in realistic environments by ab initio thermodynamics. Hume-Rothery Award Symposium, TMS2019 Annual Meeting and Exhibition, San Antonio, TX, USA (2019)
842.
Talk
Asymmetric Line Segregation at Faceted Si Grain Boundaries. TMS 2019 Annual Meeting & Exhibition, San Antonio, TX, USA (2019)
843.
Talk
Application of Density Functional Theory in the Context of Phase Diagram Modelling. MSIT Winter School on Materials Chemistry, Castle Ringberg, Tegernsee (2019)
844.
Talk
Energetics of non-stoichiometric stacking faults in Fe–Nb alloys: An ab initio study. TMS 2019 Annual Meeting, San Antonio, TX, USA (2019)
845.
Talk
Exploiting large ab initio data spaces to design materials. Openning of Christian Doppler Laboratory for nanoscale phase transformations, Linz, Austria (2019)
846.
Talk
Extending First-Principles Calculations to Model Electrochemical Reactions at the Solid-Liquid Interface. Towards Reality in Nanoscale Materials X, Levi, Finnland (2019)
847.
Talk
Exploration of large ab initio data spaces to design materials with superior mechanical properties. Physics and Theoretical Division Colloquium, Los Alamos, NM, USA (2019)
848.
Talk
A fully ab initio approach to electrochemistry and corrosion. CNLS Colloquium, Los Alamos National Laboratory, Los Alamos, NM, USA (2019)
849.
Talk
Field evaporation from a density-functional theory perspective. University Stuttgart, Online Seminar, Stuttgart, Germany (2019)
850.
Talk
Modelling electrochemical solid/liquid interfaces by first principles calculations. 19th International Workshop on Computational Physics and Material Science: Total Energy and Force Methods, ICTP, Trieste, Italy (2019)
851.
Talk
Surface rehybridization and strain effects on the composition and the properties of ternary III Nitride alloys. 19th International Conference on Crystal Growth and Epitaxy, Keystone, CO, USA (2019)
852.
Talk
Impact of chemical compositions and interstitial alloying on the stacking fault energy of CrMnFeCoNi-based HEAs from first principles. The 2nd International Conference on High-Entropy Materials , Jeju, South Korea (2018)
853.
Talk
Transition in boron boundary cohesion from effectiveness to harmfulness with respect to application temperatures: high-entropy alloys and Ni-based superalloys. 2nd International Conference on High-Entropy Materials (ICHEM 2018), Jeju, South Korea (2018)
854.
Talk
High entropy alloys beyond configurational entropy. MRS 2018 Conference, Boston, MA, USA (2018)
855.
Talk
Grain boundary dynamics. MMM 2018 (Multiscale Materials Modeling), Osaka, Japan (2018)
856.
Talk
Exploration of large ab initio data spaces to design structural materials with superior mechanical properties. Multiscale Materials Modeling (MMM 2018) Conference, Osaka, Japan (2018)
857.
Talk
Ab intiio modelling of solid/liquid interfaces: Challenges and insights. DESY Seminar, Hamburg, Germany (2018)
858.
Talk
From semiconductor defect chemistry to electrochemistry: Challenges and insights. AMaSiS 2018 Workshop, Weierstrass Institute for Applied Analysis and Stochastics, Berlin, Germany (2018)
859.
Talk
Employing ab initio thermodynamics to design structurally complex materials. RCTP-2018 Conference, Moscow, Russia (2018)
860.
Talk
Stacking fault energies of CrMnFeCoNi-based high entropy alloys from ab initio. Materials Science and Engineering 2018 (MSE) , Darmstadt, Germany (2018)