Albert Glensk
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Breakdown of the Arrhenius Law in Describing Vacancy Formation Energies: The Importance of Local Anharmonicity Revealed by Ab initio Thermodynamics
A Glensk, B Grabowski, T Hickel, J Neugebauer
Physical Review X 4 (1), 011018, 2014
Understanding Anharmonicity in fcc Materials: From its Origin to ab initio Strategies beyond the Quasiharmonic Approximation
A Glensk, B Grabowski, T Hickel, J Neugebauer
Physical review letters 114 (19), 195901, 2015
Improved method of calculating ab initio high-temperature thermodynamic properties with application to ZrC
AI Duff, T Davey, D Korbmacher, A Glensk, B Grabowski, J Neugebauer, ...
Physical Review B 91 (21), 214311, 2015
Perspectives on point defect thermodynamics
J Rogal, SV Divinski, MW Finnis, A Glensk, J Neugebauer, JH Perepezko, ...
physica status solidi (b) 251 (1), 97-129, 2014
Strong impact of lattice vibrations on electronic and magnetic properties of paramagnetic Fe revealed by disordered local moments molecular dynamics
B Alling, F Körmann, B Grabowski, A Glensk, IA Abrikosov, J Neugebauer
Physical Review B 93 (22), 224411, 2016
Anomalous Phonon Lifetime Shortening in Paramagnetic CrN Caused by Spin-Lattice Coupling: A Combined Spin and Ab Initio Molecular Dynamics Study
I Stockem, A Bergman, A Glensk, T Hickel, F Körmann, B Grabowski, ...
Physical Review Letters 121 (12), 125902, 2018
Random phase approximation up to the melting point: Impact of anharmonicity and nonlocal many-body effects on the thermodynamics of Au
B Grabowski, S Wippermann, A Glensk, T Hickel, J Neugebauer
Physical Review B 91 (20), 201103, 2015
Temperature dependence of the Gibbs energy of vacancy formation of fcc Ni
Y Gong, B Grabowski, A Glensk, F Körmann, J Neugebauer, RC Reed
Physical Review B 97 (21), 214106, 2018
Combined ab initio, experimental, and CALPHAD approach for an improved thermodynamic evaluation of the Mg–Si system
M Schick, B Hallstedt, A Glensk, B Grabowski, T Hickel, M Hampl, ...
Calphad 37, 77-86, 2012
An insight into using DFT data for Calphad modeling of solid phases in the third generation of Calphad databases, a case study for Al
S Bigdeli, LF Zhu, A Glensk, B Grabowski, B Lindahl, T Hickel, M Selleby
Calphad 65, 79-85, 2019
Phonon Lifetimes Throughout the Brillouin Zone at Elevated Temperatures from Experiment and ab initio
A Glensk, B Grabowski, T Hickel, J Neugebauer, J Neuhaus, K Hradil, ...
Physical review letters 123 (23), 235501, 2019
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
A Timely Contribution to a Half-Century-Old Topic
A Glensk, B Grabowski, T Hickel, J Neugebauer
Phys. Rev Phys Rev X 4 (4), 010001, 2014
Machine learning for metallurgy I. A neural-network potential for Al-Cu
D Marchand, A Jain, A Glensk, WA Curtin
Physical Review Materials 4 (10), 103601, 2020
Effects of aluminum on hydrogen solubility and diffusion in deformed Fe-Mn alloys
C Hüter, S Dang, X Zhang, A Glensk, R Spatschek
Advances in Materials Science and Engineering 2016, 2016
Anharmonic contributions to ab initio computed thermodynamic material properties
A Glensk
Universität Paderborn, 2015
First results
CM Home, A Glensk, B Grabowski, T Hickel, J Neugebauer
Coupled spin dynamics and ab initio molecular dynamics approach for paramagnetic materials
I Stockem, A Bergman, A Glensk, B Grabowski, F Körmann, T Hickel, ...
APS 2019, E21. 003, 2019
From Thermodynamics to phonon lifetimes: Anharmonic calculations with ab initio accuracy
A Glensk
CECAM workshop: Anharmonicity and thermal properties of solids, 2018
Ab initio determination of phonon lifetimes up to the melting point
A Glensk, B Grabowski, T Hickel, J Neugebauer, M Leitner, J Neuhaus, ...
EMRS Spring 2017, 2017
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