Publications

Chen, X.; Gonçalves, W.; Hu, Y.; Gao, Y.; Harrison, P.; Dehm, G.; Gault, B.; Ludwig, W.; Rauch, E.; Zhou, X. et al.; Raabe, D.: Secondary grain boundary dislocations alter segregation energy spectra. Nature Communications 16 (1), 8422 (2025)

Otto de Mentock, D.; Roongta, S.; Roters, F.; Eisenlohr, P.; Diehl, M.: A Python Library for Pre- and Post-Processing of DAMASK Simulations. Journal of Open Research Software 10 (105), 7164 (2025)

Motahari, S.; Liu, C.; Bai, Y.; Khorrami, M. S.; Raabe, D.: Microstructure-sensitive crystal plasticity and phase-field modeling of deformation and fracture in polycrystalline ice. Acta Materialia 283, 120512 (2025)

Chen, X.; Zhou, X.; De Geuser, F.; Kwiatkowski da Silva, A.; Zhao, H.; Woods, E.; Liu, C.; Ponge, D.; Gault, B.; Raabe, D.: Atom probe tomography-assisted kinetic assessment of spinodal decomposition in an Al-12.5 at.%Zn alloy. Acta Materialia 268, 119757 (2024)

Cantergiani, E.; Riedel, M.; Karhausen, K. F.; Roters, F.; Quadfasel, A.; Falkinger, G.; Engler, O.; Rabindran, R.: Simulations of Texture Evolution in the Near-Surface Region During Aluminum Rolling. Metallurgical and Materials Transactions A 55 (9.0), pp. 3327 - 3350 (2024)

Liu, C.; Roters, F.; Raabe, D.: Role of grain-level chemo-mechanics in composite cathode degradation of solid-state lithium batteries. Nature Communications 15 (1.0), 7970 (2024)

Yao, Y.; Euesden, R.; Curd, M. E.; Liu, C.; Garner, A.; Burnett, T. L.; Shanthraj, P.; Prangnell, P.: Effect of cooling rate on the composition and chemical heterogeneity of quench-induced grain boundary e-phase precipitates in 7xxx aluminium alloys. Acta Materialia 262, 119443 (2024)

Filiatraut, A. N.; Mianroodi, J. R.; Hamidi Siboni, N.; Zanjani, M. B.: Predicting micro/nanoscale colloidal interactions through local neighborhood graph neural networks. Journal of Applied Physics 134 (23), 234702 (2023)

Zeng, X.; Liu, C.; Zhao, C.; Dong, J.; Roters, F.; Guan, D.: Three-dimensional study of grain scale tensile twinning activity in magnesium: A combination of microstructure characterization and mechanical modeling. Acta Materialia 255, 119043 (2023)

Gallardo-Basile, F.-J.; Roters, F.; Jentner, R.; Best, J. P.; Kirchlechner, C.; Srivastava, K.; Scholl, S.; Diehl, M.: Application of a nanoindentation-based approach for parameter identification to a crystal plasticity model for bcc metals. Materials Science and Engineering A 881, 145373 (2023)

Chen, X.; Rezaei Mianroodi, J.; Liu, C.; Zhou, X.; Ponge, D.; Gault, B.; Svendsen, B.; Raabe, D.: Investigation of vacancy trapping by solutes during quenching in aluminum alloys. Acta Materialia 254, 118969 (2023)

Zubair, M.; Sandlöbes-Haut, S.; Pei, R.; Wollenweber, M. A.; Berners, L.; Kusche, C.; Liu, C.; Roters, F.; Gibson, J. S. K. L.; Korte-Kerzel, S.: Strengthening of Mg–Al–Ca alloys with C15 and C36 Laves phases. Journal of Materials Research 38 (15), pp. 3613 - 3627 (2023)

Jentner, R.; Srivastava, K.; Scholl, S.; Gallardo-Basile, F.-J.; Best, J. P.; Kirchlechner, C.; Dehm, G.: Unsupervised clustering of nanoindentation data for microstructural reconstruction: Challenges in phase discrimination. Materialia 28, 101750 (2023)

Gallardo-Basile, F.-J.; Roters, F.; Jentner, R.; Srivastava, K.; Scholl, S.; Diehl, M.: Modeling Bainite Dual-Phase Steels: A High-Resolution Crystal Plasticity Simulation Study. Crystals 13 (4), 673 (2023)

Nascimento, A.; Roongta, S.; Diehl, M.; Beyerlein, I. J.: A machine learning model to predict yield surfaces from crystal plasticity simulations. International Journal of Plasticity 161, 103507 (2023)

Cantergiani, E.; Weißensteiner, I.; Grasserbauer, J.; Falkinger, G.; Pogatscher, S.; Roters, F.: Influence of Hot Band Annealing on Cold-Rolled Microstructure and Recrystallization in AA 6016. Metallurgical and Materials Transactions A 54, pp. 75 - 96 (2023)

Liu, C.; Roters, F.; Raabe, D.: Finite strain crystal plasticity-phase field modeling of twin, dislocation, and grain boundary interaction in hexagonal materials. Acta Materialia 242, 118444 (2023)

Zhou, X.; Bai, Y.; El-Zoka, A.; Kim, S.-H.; Ma, Y.; Liebscher, C.; Gault, B.; Mianroodi, J. R.; Dehm, G.; Raabe, D.: Effect of Pore Formation on Redox-Driven Phase Transformation. Physical Review Letters 130, 168001 (2023)

Cantergiani, E.; Sauvage, X.; Scott, C.; Weck, A.: Rapid Strengthening of Interstitial Free Steel Using Amorphous FeC Thin Films and Induction Heating. Journal of Materials Engineering and Performance 31 (11), pp. 9303 - 9317 (2022)

Peivaste, I.; Hamidi Siboni, N.; Alahyarizadeh, G.; Ghaderi, R.; Svendsen, B.; Raabe, D.; Mianroodi, J. R.: Machine-learning-based surrogate modeling of microstructure evolution using phase-field. Computational Materials Science 214, 111750 (2022)