Mockute, A.; Palisaitis, J.; Alling, B.; Berastegui, P.; Broitman, E.; Näslund, L. Å.; Nedfors, N.; Lu, J.; Jensen, J. M.; Hultman, L. et al.; Patscheider, J.; Jansson, U.; Persson, P. O. Å.; Rosén, J. A.: Age hardening in (Ti_{1 − x}Al_x)B_{2 + Δ} thin films. Scripta Materialia 127, S. 122 - 126 (2017)

Divinski, S. V.; Kulitcki, V.; Kavakbasi, B. T.; Gupta, A.; Buranova, Y.; Hickel, T.; Neugebauer, J.; Wilde, G.: Grain boundary diffusion in severely deformed Al-based alloy. Condensed Matter: Materials Science, 06694 (2017)

Herbig, M.; Liebscher, C.; Scheu, C.; Hickel, T.: Leichte Hoch-Mangan-Stähle: Fortschritt durch atomistisches Verständnis. Stahl und Eisen 137 (6), S. 85 - 85 (2017)

Hickel, T.; Roters, F.; Raabe, D.; Neugebauer, J.: Quantenmechanisch geführtes Design von TWIP-Stählen. Stahl und Eisen 137, S. 58 - 58 (2017)

Kirchlechner, C.; Djaziri, S.; Li, Y.; Herbig, M.; Grabowski, B.; Nematollahi, G. A.; Goto, S.; Kirchheim, R.; Neugebauer, J.; Raabe, D. et al.; Dehm, G.: Konkurrenzlose Festigkeit durch extremes Umformen von Stahl. Stahl und Eisen 137 (8), S. 58 - 58 (2017)

Koprek, A.; Cojocaru-Mirédin, O.; Würz, R.; Freysoldt, C.; Gault, B.; Raabe, D.: Cd and Impurity Redistribution at the CdS/CIGS Interface After Annealing of CIGS-Based Solar Cells Resolved by Atom Probe Tomography. IEEE Journal of Photovoltaics 7 (1), 7762819, S. 313 - 321 (2017)

Körmann, F.; Ikeda, Y.; Grabowski, B.; Sluiter, M. H. F.: Phonon broadening in High Entropy Alloys. npj Computational Materials 3, 36 (2017)

Man, H.; Guo, J.; Zhang, R.; Schönemann, R.; Yin, Z.; Fu, M.; Stone, M. B.; Huang, Q.; Song, Y.; Wang, W. et al.; Singh, D.; Lochner, F.; Hickel, T.; Eremin, I.; Harriger, L.; Lynn, J. W.; Broholm, C.; Balicas, L.; Si, Q.; Dai, P.: Spin excitations and the Fermi surface of superconducting FeS. npj Quantum Materials 2, 14, S. 1 - 9 (2017)

Friák, M.; Holec, D.; Jirásková, Y.; Palm, M.; Stein, F.; Janičkovič, D.; Pizúrová, N.; Dymáček, P.; Dobeš, F.; Šesták, P. et al.; Fikar, J.; Šremr, J.; Nechvátal, L.; Oweisová, S.; Homola, V.; Titov, A.; Slávik, A.; Miháliková, I.; Pavlů, J.; Buršíková, V.; Neugebauer, J.; Boutur, D.; Lapusta, Y.; Šob, M.: Theory-guided Design of Novel Fe–Al-based Superalloys. In: Proc. Intermetallics 2017, S. 123 - 125 (Hg. Heilmaier, M.; Krüger, M.; Mayer, S.; Palm, M.; Stein, F.). Intermetallics 2017, Educational Center Kloster Banz, Bad Staffelstein, Germany, 02. Oktober 2017 - 06. Oktober 2017. Conventus Congressmanagement & Marketing GmbH, Jena, Germany (2017)

Zendegani, A.; Šlapáková Poková, M.; Liebscher, C.; Stein, F.; Ladines, A. N. C.; Hammerschmidt, T.; Drautz, R.; Körmann, F.; Hickel, T.; Neugebauer, J.: Impact of Magnetism on the Stability of Topologically Close-packed (TCP) Phases in Fe–Nb Alloys. In: Proc. Intermetallics 2017, S. 89 - 90 (Hg. Heilmaier, M.; Krüger, M.; Mayer, S.; Palm, M.; Stein, F.). Intermetallics 2017, Educational Center Kloster Banz, Bad Staffelstein, Germany, 02. Oktober 2017 - 06. Oktober 2017. Proc. Intermetallics 2017, Jena, Germany (2017)

Katnagallu, S.; Nematollahi, G. A.; Dagan, M.; Moody, M. P.; Grabowski, B.; Gault, B.; Raabe, D.; Neugebauer, J.: High Fidelity Reconstruction of Experimental Field Ion Microscopy Data by Atomic Relaxation Simulations. In: Proceedings of Microscopy & Microanaalysis 2017, Bd. 23, S. 642 - 643. Microscopy and Microanalysis 2017, St. Louis, MO, USA, 06. August 2017 - 10. August 2017. Cambridge University Press, New York, NY, USA (2017)

Grabowski, B.: Knowledge driven engineering of materials: Development and application of ab initio based scale bridging methods. Seminar at University Stuttgart, Stuttgart, Germany (2017)

Neugebauer, J.: A first principles approach to model electrochemical reactions in an electrolytic cell. Workshop: The Electrode Potential in Electrochemistry - A Challenge for Electronic Structure Theory Calculations, Schloß Reisensburg, Günzburg, Germany (2017)

Todorova, M.: Selective stabilization of polar oxide surfaces in electrochemical environment. Workshop: The Electrode Potential in Electrochemistry - A Challenge for Electronic Structure Theory Calculations, Schloß Reisensburg, Günzburg, Germany (2017)

Dutta, B.; Körmann, F.; Hickel, T.; Neugebauer, J.: Temperature-driven effects in functional materials: Ab initio insights. Talk at University Pierre and Marie CURIE (UPMC), Paris, France (2017)

Stockem, I.: The interaction of spin dynamics and lattice vibrations of CrN in the paramagnetic state. BIfAM Seminar, Bielefeld, Germany (2017)

Neugebauer, J.: Free energy sampling strategies for structurally complex materials. Workshop II: Stochastic Sampling and Accelerated Time Dynamics on Multidimensional Surfaces, IPAM, UCLA, Los Angeles, CA, USA (2017)

Todorova, M.: Free energy sampling for electrochemical systems. Workshop II: Stochastic Sampling and Accelerated Time Dynamics on Multidimensional Surfaces, IPAM, UCLA, Los Angeles, CA, USA (2017)

Neugebauer, J.: Materials Discovery and Design at Finite Temperatures. MS&T 2017, Pittsburgh, PA, USA (2017)

Hadian, R.: Atomistic Simulations on Grain Boundary Migration. Keynote talk, MS&T Conference, Pittsburgh, PN, USA (2017)