| ‘Anti-sluggish’Ti diffusion in HCP high-entropy alloys: Chemical complexity vs. lattice distortions S Sen, X Zhang, L Rogal, G Wilde, B Grabowski, SV Divinski Scripta Materialia 224, 115117, 2023 | 20 | 2023 |
| “Treasure maps” for magnetic high-entropy-alloys from theory and experiment F Körmann, D Ma, DD Belyea, MS Lucas, CW Miller, B Grabowski, ... Applied Physics Letters 107 (14), 2015 | 102 | 2015 |
| 5 SCIENTIFIC HIGHLIGHT OF THE MONTH: Advancing DFT to finite temperatures: Methods and applications in steel design T Hickel, B Grabowski, F Körmann, J Neugebauer | 1 | 2011 |
| A Combined Experimental and First-Principles Based Assessment of Finite-Temperature Thermodynamic Properties of Intermetallic Al3Sc A Gupta, B Tas, D Korbmacher, B Dutta, Y Neitzel, B Grabowski, T Hickel, ... Materials 14 (8), 1837, 2021 | 9 | 2021 |
| A fully automated approach to calculate the melting temperature of elemental crystals LF Zhu, J Janssen, S Ishibashi, F Körmann, B Grabowski, J Neugebauer Computational Materials Science 187, 110065, 2020 | 30 | 2020 |
| A machine learning approach to model solute grain boundary segregation L Huber, R Hadian, B Grabowski, J Neugebauer npj Computational Materials 4 (1), 64, 2018 | 106 | 2018 |
| A map for phase-change materials D Lencer, M Salinga, B Grabowski, T Hickel, J Neugebauer, M Wuttig Nature Materials 7 (12), 972-977, 2008 | 815 | 2008 |
| A QM/MM approach for low-symmetry defects in metals L Huber, B Grabowski, M Militzer, J Neugebauer, J Rottler Computational Materials Science 118, 259-268, 2016 | 18 | 2016 |
| A Timely Contribution to a Half-Century-Old Topic A Glensk, B Grabowski, T Hickel, J Neugebauer PHYSICAL REVIEW Phys Rev X 4 (4), 010001, 2014 | 2 | 2014 |
| Ab initio assisted design of quinary dual-phase high-entropy alloys with transformation-induced plasticity Z Li, F Körmann, B Grabowski, J Neugebauer, D Raabe Acta Materialia 136, 262-270, 2017 | 332 | 2017 |
| Ab initio based method to study structural phase transitions in dynamically unstable crystals, with new insights on the to transformation in titanium D Korbmacher, A Glensk, AI Duff, MW Finnis, B Grabowski, J Neugebauer Physical Review B 100 (10), 104110, 2019 | 12 | 2019 |
| Ab initio based understanding of the segregation and diffusion mechanisms of hydrogen in steels T Hickel, R Nazarov, EJ McEniry, G Leyson, B Grabowski, J Neugebauer JOM 66 (8), 1399-1405, 2014 | 89 | 2014 |
| Ab initio machine-learning unveils strong anharmonicity in non-Arrhenius self-diffusion of tungsten X Zhang, SV Divinski, B Grabowski arXiv preprint arXiv:2311.00633, 2023 | 2 | 2023 |
| Ab initio modelling of solute segregation energies to a general grain boundary L Huber, B Grabowski, M Militzer, J Neugebauer, J Rottler Acta Materialia 132, 138-148, 2017 | 54 | 2017 |
| Ab initio phase stabilities and mechanical properties of multicomponent alloys: A comprehensive review for high entropy alloys and compositionally complex alloys Y Ikeda, B Grabowski, F Körmann Materials Characterization 147, 464-511, 2019 | 291 | 2019 |
| Ab initio prediction of vacancy energetics in HCP Al-Hf-Sc-Ti-Zr high entropy alloys and the subsystems X Zhang, SV Divinski, B Grabowski Acta Materialia 227, 117677, 2022 | 40 | 2022 |
| Ab initio simulations of the surface free energy of TiN(001) A Forslund, X Zhang, B Grabowski, AV Shapeev, AV Ruban Physical Review B 103 (19), 195428, 2021 | 11 | 2021 |
| Ab Initio Study of Advanced Metallic Nuclear Fuels for Fast Breeder Reactors A Landa, P Söderlind, B Grabowski, PEA Turchi, AV Ruban, L Vitos MRS Proceedings 1444, mrss12-1444-y01-01, 2012 | 6 | 2012 |
| Ab initio study of the thermodynamic properties of nonmagnetic elementary fcc metals: Exchange-correlation-related error bars and chemical trends B Grabowski, T Hickel, J Neugebauer Physical Review B 76 (2), 024309, 2007 | 287 | 2007 |
| Ab initio thermodynamics of the CoCrFeMnNi high entropy alloy: Importance of entropy contributions beyond the configurational one D Ma, B Grabowski, F Körmann, J Neugebauer, D Raabe Acta Materialia 100, 90-97, 2015 | 476 | 2015 |
Jörg NeugebauerDirector, Max-Planck-Institut für Eisenforschung在 mpie.de 的电子邮件经过验证
