Publications of Tilmann Hickel

Janßen, J.; Hickel, T.; Neugebauer, J.: pyiron – an integrated development environment for ab initio thermodynamics. AMS Seminar, virtual, Bochum, Germany (2020)

Janßen, J.; Hickel, T.; Neugebauer, J.: Automated ab-initio Determination of Materials Properties at finite Temperatures with pyiron. NIST Workshop, virtual, Rockville, MD, USA (2020)

Neugebauer, J.; Lymperakis, L.; Janßen, J.; Huber, L.; Hickel, T.: Modeling crystal growth and materials design in high dimensional chemical and structural configuration spaces. German Conference on Crystal Growth DKT 2020, München/Garching, Germany (2020)

Neugebauer, J.; Janßen, J.; Huber, L.; Ikeda, Y.; Körmann, F.; Grabowski, B.; Hickel, T.; Shapeev, A.: Materials Design in High Dimensional Chemical and Structural Configuration Spaces. TMS 2020 Annual Meeting & Exhibition, San Diego, CA, USA (2020)

Hickel, T.: Application of Density Functional Theory in the Context of Phase Diagram Modelling. MSIT Winter School on Materials Chemistry, Virtual Event, Castle Ringberg, Tegernsee (2020)

Hickel, T.; McEniry, E.; Nazarov, R.; Dey, P.: Ab initio basierte Simulation zur Wasserstoffversprödung in hoch-Mn Stählen. Seminar der Staatlichen Materialprüfungsanstalt Darmstadt, Institut für Werkstoffkunde, Darmstadt, Germany (2020)

Hickel, T.; Aydin, U.; Sözen, H. I.; Dutta, B.; Pei, Z.; Neugebauer, J.: Innovative concepts in materials design to boost renewable energies. Seminar of Institute for Innovative Technologies, SRH Berlin University of Applied Sciences, Berlin, Germany (2020)

Neugebauer, J.; Janßen, J.; Huber, L.; Körmann, F.; Hickel, T.; Grabowski, B.: Construction and exploitation of large ab initio data spaces to design materials with superior mechanical properties. MRS-J: Materials Research Meeting 2019, Yokohama, Japan (2019)

Janßen, J.; Hickel, T.; Neugebauer, J.: Automated ab-initio Determination of Materials Properties at finite Temperatures with pyiron. CNLS Seminar, Los Alamos, NM, USA (2019)

Neugebauer, J.; Janßen, J.; Körmann, F.; Hickel, T.; Grabowski, B.: Ab initio descriptors to design materials with superior mechanical properties. Materials Day, ETH Zürich, Zürich, Switzerland (2019)

Neugebauer, J.; Stockem, I.; Hegde, O.; Freysoldt, C.; Körmann, F.; Hickel, T.; Alling, B.: Ab initio description of coupling phenomena between magnetic and structural degrees of freedom. EASTMAG2019 – VII Euro-Asian Symposium “Trends in Magnetism”, Jekaterinburg, Russia (2019)

Hickel, T.; Janßen, J.; Sözen, H. I.; Körmann, F.; Neugebauer, J.; Lysogorskiy, Y.; Drautz, R.: Ab initio simulation of finite temperature phase stabilities: Concepts and application. HetSys Launch Event, Warwick, UK (2019)

Zendegani, A.; Šlapáková Poková, M.; Liebscher, C.; Stein, F.; Kumar, K. S.; Hammerschmidt, T.; Hickel, T.; Neugebauer, J.: Atomistic investigation of stacking faults in non-stoichiometric Fe–Nb Alloys. EUROMAT 2019, Stockholm, Sweden (2019)

Neugebauer, J.; Huber, L.; Körmann, F.; Grabowski, B.; Hickel, T.: Ab initio input for multiphysics models: Accuracy, performance and challenges. ISAM4: The fourth International Symposium on Atomistic and Multiscale Modeling of Mechanics and Multiphysics, Erlangen, Germany (2019)

Hickel, T.; Gupta, A.; Neugebauer, J.; Kavakbasi, B. T.; Buranova, Y.; Kulitskiy, V. A.; Wilde, G.; Divinski, S. V.: Precipitate-induced nonlinearities of solute diffusion in Al-based alloys. 15th Diffusion in Solids and Liquids (DSL) Conference, Athens, Greece (2019)

Hickel, T.; Dutta, B.; Stockem, I.; Körmann, F.; Neugebauer, J.: Ab initio design strategies for NiMn-based FSMA. 6th Int. Conf. of Ferromagnetic Shape-Memory Alloys CFSMA, Prague, Czech Republic (2019)

Neugebauer, J.; Janßen, J.; Körmann, F.; Hickel, T.; Grabowski, B.: Exploiting large ab initio data spaces to design materials with superior mechanical propertiess. 2019 BIOVIA User Conference, Düsseldorf, Germany (2019)

Neugebauer, J.; Janßen, J.; Hickel, T.: Automated uncertainty analysis and quantification for high-precision DFT calculations. Workshop "Precision Quantification in DFT", Louvaine-la-Neuve, Belgien (2019)

Tehranchi, A.; Hickel, T.; Neugebauer, J.: Atomistic simulations of hydrogen-defect interactions in metals. Workshop "Hydrogen in Metals - current understanding and future needs", St Anne's College, Oxford, UK (2019)

Hickel, T.; Janßen, J.; Sözen, H. I.; Körmann, F.; Surendralal, S.; Todorova, M.; Lysogorskiy, Y.; Drautz, R.; Neugebauer, J.: High-throughput optimization of finite temperature phase stabilities: Concepts and application. DPG Frühjahrstagung der Sektion Kondensierte Materie, Regensburg, Germany (2019)