Suchergebnisse

Zhu, L.-F.; Körmann, F.; Chen, Q.; Selleby, M.; Neugebauer, J.; Grabowski, B.: Accelerating ab initio melting property calculations with machine learning: application to the high entropy alloy TaVCrW. npj Computational Materials 10 (1), 274 (2024)

Chakrabartty, S.; Parse, H.; Krämer, M.; Kim, S.-H.; Raabe, D.; Gault, B.; Sokol, M.; Rosen, B.; Eliaz, N.: Ti₃C₂T_z Supported Pulse-Electrodeposited Pt Nanostructures for Enhanced Acidic Electrochemical Hydrogen Evolution. ChemCatChem 16 (22), e202401088 (2024)

Han, L.; Peter, N.; Maccari, F.; Kovács, A.; Wang, J.; Zhang, Y.; Xie, R.; Wu, Y.; Schwaiger, R.; Zhang, H. et al.; Li, Z.; Gutfleisch, O.; Dunin-Borkowski, R.; Raabe, D.: Two-gigapascal-strong ductile soft magnets. Nature Communications 15 (1), 10119 (2024)

Janßen, J.; Makarov, E.; Hickel, T.; Shapeev, A. V.; Neugebauer, J.: Automated optimization and uncertainty quantification of convergence parameters in plane wave density functional theory calculations. npj Computational Materials 10 (1), 263 (2024)

Menon, S.; Lysogorskiy, Y.; Knoll, A. L. M.; Leimeroth, N.; Poul, M.; Qamar, M.; Janssen, J.; Mrovec, M.; Rohrer, J.; Albe, K. et al.; Behler, J.; Drautz, R.; Neugebauer, J.: From electrons to phase diagrams with machine learning potentials using pyiron based automated workflows. npj Computational Materials 10 (1), 261 (2024)

Son, J.; Kim, J.; Lee, C.-G.; Park, J.; Kim, J.; Kim, S.-H.; Gault, B.; Seo, D.; Seok Jung, Y.: Dual-Function ZnO-Li₃TaO₄ Surface Modification of Single-Crystalline Ni-Rich Cathodes for All-Solid-State Batteries. ACS Energy Letters 9 (11), S. 5403 - 5412 (2024)

Chao Yang ; Chen, X.; Xia, W.; Hu, J.; Zhang, J.; Zhang, S.; Zhou, D.; Lu, W.; Shu, D.; Zhang, D.: Strong and stable ultrafine-grained Al–Mg alloys via polymer-derived in situ nanoparticles. Materials Science and Engineering A: Structural Materials Properties Microstructure and Processing 915, 147298 (2024)

Ding, R.; Yao, Y.; Sun, B.; Guo, H.; Zhang, J.; Shao, Y.; Zhang, C.; Liu, W.; Godfrey, A.; Yang, Z. et al.; Huang, X.; Liu, Y.; van der Zwaag, S.; Chen, H.: Strong yet ductile steels via a heterogeneous phase transformation strategy. Scripta Materialia 252, 116274 (2024)

Gathmann, M.; Moisi, D.; Springer, H.: Coarsening mechanism of M₂B-borides and their effect on the mechanical properties of high modulus steels. Materials & Design 247, 113411 (2024)

Huang, S.; Tegg, L.; Aminorroaya Yamini, S.; McCarroll, I.; Burr, P. A.; Cairney, J. M.: Atom probe tomography of deuterium-charged optimised ZIRLO. Journal of Materials Science 59 (43), S. 20418 - 20427 (2024)

Leineweber, A.; Stein, F.: Comment on Hajra et al.: “High-temperature phase stability and phase transformations of Niobium-Chromium Laves phase: Experimental and first-principles calculation”. Materials and Design 247, 113373 (2024)

Warden, G. K.; Ebbinghaus, P.; Rabe, M.; Juel, M.; Gaweł, B. A.; Erbe, A.; Di Sabatino, M.: Investigation of uniformity in fused quartz crucibles for Czochralski silicon ingots. Journal of Crystal Growth 645, 127844 (2024)

Wittrock, A.; Heermant, S.; Beckmann, C.; Wimmer, M.; Fischer, A.; Aßmann, M.; Debus, J.: Protein-metal interactions due to fretting corrosion at the taper junction of hip implants: An in vitro investigation using Raman spectroscopy. Acta Biomaterialia 189, S. 621 - 632 (2024)

Gathmann, M.; Tönnißen, N.; Baron, C.; Kostka, A.; Steinbacher, M.; Springer, H.: Surface hardening of high modulus steels through carburizing and nitriding: First insights into microstructure property relationships. Surface and Coatings Technology 494 (Part 1), 131354 (2024)

Liu, C.; Rao, J.; Sun, Z.; Lu, W.; Best, J. P.; Li, X.; Xia, W.; Gong, Y.; Wei, Y.; Zhang, B. et al.; Ding, J.; Wu, G.; Ma, E.: Near-theoretical strength and deformation stabilization achieved via grain boundary segregation and nano-clustering of solutes. Nature Communications 15, 9283 (2024)

Devulapalli, V.; Chen, E.; Brink, T.; Frolov, T.; Liebscher, C.: Topological grain boundary segregation transitions. Science 386 (6720), S. 420 - 424 (2024)

Jovičević-Klug, P.; Prabhakar, J. M.; Kasdorf Giesbrecht, C.; Schwarz, T.; Bonnekoh, C.; Rieth, M.; Rohwerder, M.: Hydrogen diffusion and trapping in a cryogenic processed high-Cr ferrous alloy. npj Materials Degradation 8 (1), 104 (2024)

Wang, C.; Wang, L.; Nallathambi, V.; Liu, Y.; Kresse, J.; Hübner, R.; Reichenberger, S.; Gault, B.; Zhan, J.; Eychmüller, A. et al.; Cai, B.: Structural Regulation of Au-Pt Bimetallic Aerogels for Catalyzing the Glucose Cascade Reaction. Advanced Materials 36 (41), 2405200 (2024)

Geng, X.; Vega-Paredes, M.; Wang, Z.; Ophus, C.; Lu, P.; Ma, Y.; Zhang, S.; Scheu, C.; Liebscher, C.; Gault, B.: Grain boundary engineering for efficient and durable electrocatalysis. Nature Communications 15, 8534 (2024)

Pei, Z.; Gong, Y.; Liu, X.; Yin, J.: Designing complex concentrated alloys with quantum machine learning and language modeling. Matter 7, S. 3433 - 3446 (2024)