Publications

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)

Kühbach, M. T.; Kasemer, M.; Gault, B.; Breen, A. J.: Open and strong-scaling tools for atom-probe crystallography: high-throughput methods for indexing crystal structure and orientation. Journal of Applied Crystallography 54 (Pt 5), pp. 1490 - 1508 (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)

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)

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)

Lin, Y.-Y.; Schleifer, F.; Holzinger, M.; Ta, N.; Skrotzki, B.; Kamachali, R. D.; Glatzel, U.; Fleck, M.: Quantitative Shape-Classification of Misfitting Precipitates during Cubic to Tetragonal Transformations: Phase-Field Simulations and Experiments. Materials 14 (6), 1373 (2021)

Ta, N.; Bilal, M. U.; Häusler, I.; Saxena, A.; Lin, Y.-Y.; Schleifer, F.; Fleck, M.; Glatzel, U.; Skrotzki, B.; Kamachali, R. D.: Simulation of the θ’ precipitation process with interfacial anisotropy effects in Al–Cu alloys. Materials 14 (5), 1280 (2021)

Croteau, J.-F.; Peroni, M.; Atieh, S.; Jacques, N.; Cantergiani, E.: Effect of Strain Rate on the Tensile Mechanical Properties of Electron Beam Welded OFE Copper and High-Purity Niobium for SRF Applications. Journal of Dynamic Behavior of Materials 7 (3), pp. 485 - 498 (2021)

Sharma, L.; Peerlings, R. H. J.; Geers, M. G. D.; Roters, F.: Integral nonlocal approach to model interface decohesion in FFT solvers. Engineering Fracture Mechanics 243, 107516 (2021)

Gallardo-Basile, F.-J.; Naunheim, Y.; Roters, F.; Diehl, M.: Lath Martensite Microstructure Modeling: A High-Resolution Crystal Plasticity Simulation Study. Materials, Special Issue "Micromechanics: Experiment, Modeling and Theory" 14 (3), pp. 691 - 709 (2021)

Wei, X.; Jin, L.; Liu, C.; Wang, F.; Dong, S.; Dong, J.: Effect of pack-forging on microstructure and properties of Mg–Gd–Y–Zn–Zr alloy. Materials Science and Engineering A: Structural Materials Properties Microstructure and Processing 802, 140674 (2021)

Garner, A.; Euesden, R.; Yao, Y.; Aboura, Y.; Zhao, H.; Donoghue, J.; Curioni, M.; Gault, B.; Shanthraj, P.; Barrett, Z. et al.; Engel, C.; Burnett, T. L.; Prangnell, P.: Multiscale analysis of grain boundary microstructure in high strength 7xxx Al alloys. Acta Materialia 202, pp. 190 - 210 (2021)

Kühbach, M. T.; London, A. J.; Wang, Jing, J.; Schreiber, D. K.; Mendez Martin, F.; Ghamarian, I.; Bilal, H.; Ceguerra, A. V.: Community-Driven Methods for Open and Reproducible Software Tools for Analyzing Datasets from Atom Probe Microscopy. Microscopy and Microanalysis, pp. 1 - 16 (2021)

Vakili, S.; Steinbach, I.; Varnik, F.: Author Correction: Multi-phase-field simulation of microstructure evolution in metallic foams (Scientific Reports, (2020), 10, 1, (19987), 10.1038/s41598-020-76766-z). Scientific Reports 11 (1), 16326 (2021)

Roters, F.; Diehl, M.; Eisenlohr, P.; Shanthraj, P.: DAMASK: the Düsseldorf Advanced MAterial Simulation Kit for studying multi-field crystal plasticity phenomena. Seminar, Engineering Science Department at the University of Oxford, virtual, Oxford, UK (2021)

Zhou, X.; Wei, Y.; Zhao, H.; Vogel, F.; Darvishi Kamachali, R.; Thompson, G. B.; Raabe, D.; Gault, B.: Revealing in-plane grain boundary composition features through machine learning from atom probe tomography. DPG Conference 2021, Online, Germany (2021)

Roongta, S.; Diehl, M.; Roters, F.: Multiphysics simulations in DAMASK. Euromat 2021, Virtual (2021)