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Nature Communications
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January 4, 2025
Ab initio machine-learning unveils strong anharmonicity in non-Arrhenius self-diffusion of tungsten
Xi Zhang, Sergiy V Divinski, Blazej Grabowski
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
June 23, 2011
Determination of symmetry reduced structures using a soft phonon analysis for magnetic shape memory alloys (abstract only)
Tilmann Hickel, Matthé Uijttewaal, Blazej Grabowski, et al.
Npj Computational Materials
|
January 12, 2026
Free-energy perturbation in the exchange-correlation space accelerated by machine learning: application to silica polymorphs
Axel Forslund, Jong Hyun Jung, Yuji Ikeda, et al.
Nature Materials
|
November 18, 2008
A map for phase-change materials
Dominic Lencer, Martin Salinga, Blazej Grabowski, et al.
Scientific Reports
|
May 21, 2017
Computationally-driven engineering of sublattice ordering in a hexagonal AlHfScTiZr high entropy alloy
Lukasz Rogal, Piotr Bobrowski, Fritz Körmann, et al.
Npj Computational Materials
|
December 2, 2024
Accelerating ab initio melting property calculations with machine learning: application to the high entropy alloy TaVCrW
Li-Fang Zhu, Fritz Körmann, Qing Chen, et al.
Proceedings. Mathematical, Physical, and Engineering Sciences
|
August 15, 2017
The role of molybdenum in suppressing cold dwell fatigue in titanium alloys
Adam J Ready, Peter D Haynes, Blazej Grabowski, et al.
Journal of the American Chemical Society
|
April 13, 2022
Li<sub>5</sub>Sn, the Most Lithium-Rich Binary Stannide: A Combined Experimental and Computational Study
Robert U Stelzer, Yuji Ikeda, Prashanth Srinivasan, et al.
Journal of Chemical Theory and Computation
|
March 3, 2026
Machine-Learning Interatomic Potentials Achieving CCSD(T) Accuracy for Systems with Extended Covalent Networks and van der Waals Interactions
Yuji Ikeda, Axel Forslund, Pranav Kumar, et al.
Physical Review Letters
|
December 24, 2019
Phonon Lifetimes throughout the Brillouin Zone at Elevated Temperatures from Experiment and Ab Initio
Albert Glensk, Blazej Grabowski, Tilmann Hickel, et al.
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Showing results (1-10 of 17) with videos related to
Sort By:
Page
of 2
Nature Communications
|
January 4, 2025
Ab initio machine-learning unveils strong anharmonicity in non-Arrhenius self-diffusion of tungsten
Xi Zhang, Sergiy V Divinski, Blazej Grabowski
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
June 23, 2011
Determination of symmetry reduced structures using a soft phonon analysis for magnetic shape memory alloys (abstract only)
Tilmann Hickel, Matthé Uijttewaal, Blazej Grabowski, et al.
Npj Computational Materials
|
January 12, 2026
Free-energy perturbation in the exchange-correlation space accelerated by machine learning: application to silica polymorphs
Axel Forslund, Jong Hyun Jung, Yuji Ikeda, et al.
Nature Materials
|
November 18, 2008
A map for phase-change materials
Dominic Lencer, Martin Salinga, Blazej Grabowski, et al.
Scientific Reports
|
May 21, 2017
Computationally-driven engineering of sublattice ordering in a hexagonal AlHfScTiZr high entropy alloy
Lukasz Rogal, Piotr Bobrowski, Fritz Körmann, et al.
Npj Computational Materials
|
December 2, 2024
Accelerating ab initio melting property calculations with machine learning: application to the high entropy alloy TaVCrW
Li-Fang Zhu, Fritz Körmann, Qing Chen, et al.
Proceedings. Mathematical, Physical, and Engineering Sciences
|
August 15, 2017
The role of molybdenum in suppressing cold dwell fatigue in titanium alloys
Adam J Ready, Peter D Haynes, Blazej Grabowski, et al.
Journal of the American Chemical Society
|
April 13, 2022
Li<sub>5</sub>Sn, the Most Lithium-Rich Binary Stannide: A Combined Experimental and Computational Study
Robert U Stelzer, Yuji Ikeda, Prashanth Srinivasan, et al.
Journal of Chemical Theory and Computation
|
March 3, 2026
Machine-Learning Interatomic Potentials Achieving CCSD(T) Accuracy for Systems with Extended Covalent Networks and van der Waals Interactions
Yuji Ikeda, Axel Forslund, Pranav Kumar, et al.
Physical Review Letters
|
December 24, 2019
Phonon Lifetimes throughout the Brillouin Zone at Elevated Temperatures from Experiment and Ab Initio
Albert Glensk, Blazej Grabowski, Tilmann Hickel, et al.
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of 2