Just another WordPress site - Ruhr-Universität Bochum
2026
- F. Körmann, Y. Ikeda, K. Glazyrin et al. Hydrogen uptake and hydride formation in AlxCoCrFeNi high-entropy alloys: First-principles, universal-potential, and experimental study. Acta Materialia, 313, 122300, (2026)
- T. Cavignac, J. Schmidt, P. De Breuck et al. AI-driven expansion and application of the Alexandria database. Journal of Physics: Materials, 9, 025014, (2026)
- A. Vesti, D. Music, M. Forti et al. Mechanical stability and fracture behavior of the WOs sigma phase: Effects of composition and lattice-site occupancy. Computational Materials Science, 269, 114699, (2026)
- E. Ibrahim, Y. Lysogorskiy, R. Drautz et al. Water phase diagram from a general-purpose atomic cluster expansion potential. Journal of Chemical Theory and Computation, 22, 4758, (2026)
- M. Forti, A. Malakhova, Y. Lysogorskiy et al. Data-efficient machine-learning of complex Fe–Mo intermetallics using domain knowledge of chemistry and crystallography. npj Computational Materials, 12, 161, (2026)
- P. Kumar, F. Körmann, K. Edalati et al. Hydrogen diffusion in TiCr2H Laves phases: A combined ab initio and machine-learning-potential study. Acta Materialia, 308, 122048, (2026)
- Z. Pei, Y. Gong, P. Singh et al. Can chemical short-range order be transformed into a practical alloy-engineering tool?. Current Opinion in Solid State and Materials Science, 41, 101254, (2026)
- K. Glazyrin, K. Spektor, M. Bykov et al. Synthesis of high-entropy hydride from the cantor alloy (fcc–CoCrFeNiMn) at extreme conditions. Nature Communications, 17, 2622, (2026)
- Y. Lysogorskiy, A. Bochkarev, R. Drautz. Graph atomic cluster expansion for foundational machine learning interatomic potentials. npj Computational Materials, 12, 114, (2026)
- F. Körmann, A. Forslund, Y. Ikeda et al. Impact of thermal excitations on the stabilization of the disordered VCoNi alloy. Physical Review Materials, 10, 023604, (2026)
- S. Starikov, P. Grigorev, S.-H. Lee et al. Angular-dependent interatomic potential for large-scale simulation of bcc and hcp multi-component refractory alloys. Computational Materials Science, 262, 114369, (2026)
- X. Wu, Z. Sun, W. Guo et al. Microstructural origin of the simultaneous enhancements in strength and ductility of a nitrogen-doped high-entropy alloy. Acta Materialia, 304, 121753, (2026)