Publications of the Atomistic Modelling GroupThis list consists only of publications since the formation of the group "Atomistic Modelling of Material Interfaces". If you click on an author's name, you will be directed to the authors complete MPS publication list.

Publications of Dierk Raabe

Journal Article (837)

1.
Journal Article
Zhao, H.; Yin, Y.; Wu, Y.; Zhang, S.; Mingers, A. M.; Ponge, D.; Gault, B.; Rohwerder, M.; Raabe, D.: How solute atoms control aqueous corrosion of Al-alloys. Nature Communications 15 (1), 561 (2024)
2.
Journal Article
Zhou, X.; Ahmadian, A.; Gault, B.; Ophus, C.; Liebscher, C.; Dehm, G.; Raabe, D.: Atomic motifs govern the decoration of grain boundaries by interstitial solutes. Nature Communications 14, 3535 (2023)
3.
Journal Article
Mianroodi, J. R.; Shanthraj, P.; Kwiatkowski da Silva, A.; Svendsen, B.; Raabe, D.: Combined modeling and experimental characterization of Mn segregation and spinodal decomposition along dislocation lines in Fe–Mn alloys. Acta Materialia 251, 118873 (2023)
4.
Journal Article
Pei, Z.; Yin, J.; Liaw, P. K.; Raabe, D.: Toward the design of ultrahigh-entropy alloys via mining six million texts. Nature Communications 14, 54 (2023)
5.
Journal Article
Raabe, D.; Mianroodi, J. R.; Neugebauer, J.: Accelerating the design of compositionally complex materials via physics-informed artificial intelligence. Nature Computational Science 3 (3), pp. 198 - 209 (2023)
6.
Journal Article
Sasidhar, K. N.; Khanchandani, H.; Zhang, S.; Kwiatkowski da Silva, A.; Scheu, C.; Gault, B.; Ponge, D.; Raabe, D.: Understanding the protective ability of the native oxide on an Fe-13 at% Cr alloy at the atomic scale: A combined atom probe and electron microscopy study. Corrosion Science 211, 110848 (2023)
7.
Journal Article
Liu, T.; Liang, L.; Raabe, D.; Dai, L.: The martensitic transition pathway in steel. Journal of Materials Science & Technology 134, pp. 244 - 253 (2023)
8.
Journal Article
Li, Y.; Guo, Y.; Li, L.; Kang, J.; Yan, F.; Du, P.; Raabe, D.; Wang, G.: Ductile 2-GPa steels with hierarchical substructure. Science 379 (6628), pp. 168 - 173 (2023)
9.
Journal Article
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)
10.
Journal Article
Ma, Y.; Bae, J. W.; Kim, S.-H.; Jovičević-Klug, M.; Li, K.; Vogel, D.; Ponge, D.; Rohwerder, M.; Gault, B.; Raabe, D.: Reducing Iron Oxide with Ammonia: A Sustainable Path to Green Steel. Advanced Science, 2300111 (2023)
11.
Journal Article
Raabe, D.: The Materials Science behind Sustainable Metals and Alloys. Chemical Reviews 123 (5), pp. 2436 - 2608 (2023)
12.
Journal Article
Souza Filho, I. R.; Ma, Y.; Raabe, D.; Springer, H.: Fundamentals of Green Steel Production: On the Role of Gas Pressure During Hydrogen Reduction of Iron Ores. JOM-Journal of the Minerals Metals & Materials Society 75, pp. 2274 - 2286 (2023)
13.
Journal Article
Sun, B.; Kwiatkowski da Silva, A.; Wu, Y.; Ma, Y.; Chen, H.; Scott, C.; Ponge, D.; Raabe, D.: Physical metallurgy of medium-Mn advanced high-strength steels. International Materials Reviews (2023)
14.
Journal Article
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)
15.
Journal Article
Moravcik, I.; Zelený, M.; Dlouhý, A.; Hadraba, H.; Moravcikova-Gouvea, L.; Papež, P.; Fikar, O.; Dlouhy, I.; Raabe, D.; Li, Z.: Impact of interstitial elements on the stacking fault energy of an equiatomic CoCrNi medium entropy alloy: theory and experiments. Science and Technology of Advanced Materials 23 (1), pp. 376 - 392 (2022)
16.
Journal Article
Elkot, M.; Sun, B.; Zhou, X.; Ponge, D.; Raabe, D.: Hydrogen-assisted decohesion associated with nanosized grain boundary κ-carbides in a high-Mn lightweight steel. Acta Materialia 241, 118392 (2022)
17.
Journal Article
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)
18.
Journal Article
Choisez , L.; van Rooij, N. E.; Hessels , C. J. M.; Kwiatkowski da Silva, A.; Souza Filho, I. R.; Ma, Y.; de Goey, P.; Springer, H.; Raabe, D.: Phase transformations and microstructure evolution during combustion of iron powder. Acta Materialia 239, 118261 (2022)
19.
Journal Article
Rao, Z.; Tung, P.-Y.; Xie, R.; Wei, Y.; Zhang, H.; Ferrari, A.; Klaver, T. P. C.; Körmann, F.; Prithiv, T. S.; Kwiatkowski da Silva, A. et al.; Chen, Y.; Li, Z.; Ponge, D.; Neugebauer, J.; Gutfleisch, O.; Bauer , S.; Raabe, D.: Machine learning–enabled high-entropy alloy discovery. Science 378 (6615), pp. 78 - 85 (2022)
20.
Journal Article
Zhou, D.; Zhang, X.; Tehranchi, A.; Hou, J.; Lu, W.; Hickel, T.; Ponge, D.; Raabe, D.; Zhang, D.: Stacking faults in a mechanically strong Al(Mg)–Al3Mg2 composite. Composites Part B: Engineering 245, 110211 (2022)
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