Open Access Publications of the Department Microstructure Physics and Alloy Design

Kühbach, M. T.; Bajaj, P.; Zhao, H.; Çelik, M. H.; Jägle, E. A.; Gault, B.: On strong-scaling and open-source tools for analyzing atom probe tomography data. npj Computational Materials 7 (1), 21 (2021)

Sedighiani, K.; Shah, V.; Traka, K.; Diehl, M.; Roters, F.; Sietsma, J.; Raabe, D.: Large-deformation crystal plasticity simulation of microstructure and microtexture evolution through adaptive remeshing. International Journal of Plasticity 146, 103078 (2021)

Traka, K.; Sedighiani, K.; Bos, C.; Lopez, J. G.; Angenendt, K.; Raabe, D.; Sietsma, J.: Topological aspects responsible for recrystallization evolution in an IF-steel sheet – Investigation with cellular-automaton simulations. Computational Materials Science 198, 110643 (2021)

Wan, D.; Ma, Y.; Sun, B.; Razavi, S. M. J.; Wang, D.; Lu, X.; Song, W.: Evaluation of hydrogen effect on the fatigue crack growth behavior of medium-Mn steels via in-situ hydrogen plasma charging in an environmental scanning electron microscope. Journal of Materials Science & Technology 85, pp. 30 - 43 (2021)

Han, L.; Rao, Z.; Souza Filho, I. R.; Maccari, F.; Wei, Y.; Wu, G.; Ahmadian, A.; Zhou, X.; Gutfleisch, O.; Ponge, D. et al.; Raabe, D.; Li, Z.: Ultrastrong and Ductile Soft Magnetic High-Entropy Alloys via Coherent Ordered Nanoprecipitates. Advanced Materials 33 (37), 2102139 (2021)

Luo, T.; Serrano Sanchez, F. M.; Bishara, H.; Zhang, S.; Villoro, R. B.; Kuo, J. J.; Felser, C.; Scheu, C.; Snyder, G. J.; Best, J. P. et al.; Dehm, G.; Yu, Y.; Raabe, D.; Fu, C.; Gault, B.: Dopant-segregation to grain boundaries controls electrical conductivity of η-type NbCo(Pt)Sn half-Heusler alloy mediating thermoelectric performance. Acta Materialia 217, 117147 (2021)

Lu, E.; Zhao, J.; Makkonen, I.; Mizohata, K.; Li, Z.; Hua, M.; Djurabekova, F.; Tuomisto, F.: Enhancement of vacancy diffusion by C and N interstitials in the equiatomic FeMnNiCoCr high entropy alloy. Acta Materialia 215, 117093 (2021)

Liu, C.; Garner, A.; Zhao, H.; Prangnell, P.; Gault, B.; Raabe, D.; Shanthraj, P.: CALPHAD-informed phase-field modeling of grain boundary microchemistry and precipitation in Al-Zn-Mg-Cu alloys. Acta Materialia 214, 116966 (2021)

Prabhakar, J. M.; Varanasi, R. S.; Corrêa da Silva, C.; de Vooys, A.; Erbe, A.; Rohwerder, M.: Chromium coatings from trivalent chromium plating baths: Characterization and cathodic delamination behaviour. Corrosion Science 187, 109525 (2021)

Jang, K.; Kim, S.-H.; Jun, H.; Jung, C.; Yu, J.; Lee, S.; Choi, P.-P.: Three-dimensional atomic mapping of ligands on palladium nanoparticles by atom probe tomography. Nature Communications 12 (1), 4301 (2021)

Luo, T.; Kuo, J. J.; Griffith, K. J.; Imasato, K.; Cojocaru-Mirédin, O.; Wuttig, M.; Gault, B.; Yu, Y.; Snyder, G. J.: Nb-Mediated Grain Growth and Grain-Boundary Engineering in Mg₃Sb₂-Based Thermoelectric Materials. Advanced Functional Materials 31 (28), 2100258 (2021)

Gault, B.; Poplawsky, J. D.: Author Correction: Correlating advanced microscopies reveals atomic-scale mechanisms limiting lithium-ion battery lifetime (Nature Communications, (2021), 12, 1, (3740), 10.1038/s41467-021-24121-9). Nature Communications 12 (1), 4323 (2021)

Johny, J.; Prymak, O.; Kamp, M.; Calvo, F.; Kim, S.-H.; Tymoczko, A.; El-Zoka, A.; Rehbock, C.; Schürmann, U.; Gault, B. et al.; Kienle, L.; Barcikowski, S.: Multidimensional thermally-induced transformation of nest-structured complex Au-Fe nanoalloys towards equilibrium. Nano Research (2021)

Gault, B.; Poplawsky, J. D.: Correlating advanced microscopies reveals atomic-scale mechanisms limiting lithium-ion battery lifetime. Nature Communications 12, 3740 (2021)

Ikehata, H.; Mayweg, D.; Jägle, E. A.: Grain refinement of Fe–Ti alloys fabricated by laser powder bed fusion. Materials and Design 204, 109665 (2021)

Orava, J.; Balachandran, S.; Han, X.; Shuleshova, O.; Nurouzi, E.; Soldatov, I.; Oswald, S. E.; Gutowski, O.; Ivashko, O.; Dippel, A. C. et al.; v. Zimmermann, M.; Ivanov, Y. P.; Greer, L. A.; Raabe, D.; Herbig, M.; Kaban, I.: In situ correlation between metastable phase-transformation mechanism and kinetics in a metallic glass. Nature Communications 12, 2839 (2021)

Yilmaz, A.; Traka, K.; Pletincx, S.; Hauffman, T.; Sietsma, J.; Gonzalez-Garcia, Y.: Effect of microstructural defects on passive layer properties of interstitial free (IF) ferritic steels in alkaline environment. Corrosion Science 182, 109271 (2021)

Zhou, X.; Mianroodi, J. R.; Kwiatkowski da Silva, A.; Koenig, T.; Thompson, G. B.; Shanthraj, P.; Ponge, D.; Gault, B.; Svendsen, B.; Raabe, D.: The hidden structure dependence of the chemical life of dislocations. Science Advances 7 (16), eabf0563 (2021)

Mianroodi, J. R.; Shanthraj, P.; Svendsen, B.; Raabe, D.: Phase-field modeling of chemoelastic binodal/spinodal relations and solute segregation to defects in binary alloys. Materials 14 (7), 1787 (2021)

Fan, H.; Wang, Q.; El-Awady, J. A.; Raabe, D.; Zaiser, M.: Strain rate dependency of dislocation plasticity. Nature Communications 12 (1), 1845 (2021)