Veröffentlichungen

Tian, C.; Ma, Y.; Ghafarollahi, A.; Patil, P.; Dehm, G.; Bitzek, E.; Rasiński, M.; Best, J. P.: Segregation-enhanced grain boundary embrittlement of recrystallised tungsten evidenced by site-specific microcantilever fracture. Acta Materialia 259, 119256 (2023)

Bhatt, S.; Katnagallu, S.; Neugebauer, J.; Freysoldt, C.: Accurate computation of chemical contrast in field ion microscopy. Physical Review B 107 (23), 235413 (2023)

Starikov, S.; Smirnova, D.: Details of structure transformations in pure uranium and U-Mo alloys: Insights from classical atomistic simulation. Journal of Nuclear Materials 576, 154265 (2023)

Ferrari, A.; Körmann, F.; Asta, M. D.; Neugebauer, J.: Simulating short-range order in compositionally complex materials. Nature Computational Science 3 (3), S. 221 - 229 (2023)

Raabe, D.; Mianroodi, J. R.; Neugebauer, J.: Accelerating the design of compositionally complex materials via physics-informed artificial intelligence. Nature Computational Science 3 (3), S. 198 - 209 (2023)

Kumar, N.; Lee, Y.; Lee, G.; Lee, S.; Lee, T.; Yoo, S.-H.; Stampfl, C.; Soon, A.; Jang, W.: Oxidic structures on copper-gold alloy nanofacets. Applied Surface Science 613, 155913 (2023)

Kiranbabu, S.; Qin, Y.; Sreekala, L.; Das, S. M.; Pippan, R.; Morsdorf, L.; Herbig, M.: Decomposition-resistant carbonitride precipitates in X30CrMoN15-1 high-nitrogen bearing steel deformed by high-pressure torsion. Materials Science and Engineering A: Structural Materials Properties Microstructure and Processing 863, 144529 (2023)

Sözen, H. I.; Ener, S.; Maccari, F.; Fayyazi, B.; Gutfleisch, O.; Neugebauer, J.; Hickel, T.: Combined ab initio and experimental screening of phase stabilities in the Ce–Fe–Ti–X system (X=3d and 4d metals). Physical Review Materials 7 (1), 014410 (2023)

Katnagallu, S.; Freysoldt, C.; Gault, B.; Neugebauer, J.: Ab initio vacancy formation energies and kinetics at metal surfaces under high electric field. Physical Review B 107 (4), L041406 (2023)

Shodja, H. M.; Ordookhani, A.; Tehranchi, A.: Dynamic Concentrations and Potentials of Embedded Eccentrically Coated Magneto-Electro-Elastic Fiber Subjected to Anti-Plane Shear Waves. Journal of Elasticity 153 (1), S. 119 - 153 (2023)

Barba, D.; Egan, A.; Utada, S.; Gong, Y.; Tang, Y. T.; Mazanova, V.; Mills, M. J.; Reed, R. C.: Deformation Mechanisms Rationalisation to Design for Creep Resistance in Polycrystalline Ni-Based Superalloys. Metallurgical and Materials Transactions A 54, S. 1886 - 1901 (2023)

Iankevich, G.; Sarkar, A.; Katnagallu, S.; Chellali, M. R.; Wang, D.; Velasco, L.; Singh, R.; Reisinger, T.; Kruk, R.; Hahn, H.: A New Class of Cluster-Matrix Nanocomposite Made of Fully Miscible Components. Advanced Materials 35 (9), 2208774 (2023)

Rousseau, L.; Normand, A.; Morgado, F. F.; Scisly Søreide, H.-S. M.; Stephenson, L.; Hatzoglou, C.; Da Costa, G.; Tehrani, K.; Freysoldt, C.; Gault, B. et al.; Vurpillot, F.: Introducing field evaporation energy loss spectroscopy. Communications Physics 6, 100 (2023)

Srinivasan, P.; Shapeev, A.; Neugebauer, J.; Körmann, F.; Grabowski, B.: Anharmonicity in bcc refractory elements: A detailed ab initio analysis. Physical Review B 107 (1), 014301 (2023)

Tehranchi, A.; Zhang, S.; Zendegani, A.; Scheu, C.; Hickel, T.; Neugebauer, J.: Metastable defect phase diagrams as a tool to describe chemically driven defect formation: Application to planar defects. arXiv preprint arXiv:2303.07504 (2023)

Lakshmipathy, T.; Steinmann, P.; Bitzek, E.: LEFM is agnostic to geometrical nonlinearities arising at atomistic crack tips. Forces in Mechanics 9, 100127 (2022)

Zhang, X.; Zhang, J.; Wang, H.; Rogal, J.; Li, H.-Y.; Wei, S.-H.; Hickel, T.: Defect-characterized phase transition kinetics. Applied Physics Reviews 9 (4), 041311 (2022)

Ghosh, S.; Sotskov, V.; Shapeev, A.; Neugebauer, J.; Körmann, F.: Short-range order and phase stability of CrCoNi explored with machine learning potentials. Physical Review Materials 6 (11), 113804 (2022)

Dong, X.; Wang, D.; Prithiv, T. S.; Tehranchi, A.; Ponge, D.; Sun, B.: Hydrogen-associated decohesion and localized plasticity in a high-Mn and high-Al two-phase lightweight steel. Acta Materialia 239, 118296 (2022)

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), S. 78 - 85 (2022)