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Anharmonic effects on the dynamics of solid aluminium from ab initio simulations

Title data

Adams, Donat J. ; Wang, Lin ; Steinle-Neumann, Gerd ; Passerone, Daniele ; Churakov, Sergey V.:
Anharmonic effects on the dynamics of solid aluminium from ab initio simulations.
In: Journal of Physics: Condensed Matter. Vol. 33 (2021) Issue 17 . - 175501.
ISSN 1361-648X
DOI: https://doi.org/10.1088/1361-648x/abc972

Official URL: Volltext

Further data

Item Type: Article in a journal
Refereed: Yes
Keywords: Aluminium; Anharomic effects; Decoupled anharmonic mode approximation, DAMA; Electronic structure; Phonon dispersion; Quasi harmonic approximation; Self-consistent ab initio lattice dynamics, SCAILD
Institutions of the University: Research Institutions > Central research institutes > Bavarian Research Institute of Experimental Geochemistry and Geophysics - BGI
Research Institutions
Research Institutions > Central research institutes
Result of work at the UBT: Yes
DDC Subjects: 500 Science > 550 Earth sciences, geology
Date Deposited: 30 Mar 2022 06:30
Last Modified: 06 May 2024 13:46
URI: https://eref.uni-bayreuth.de/id/eprint/69068