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Towards the high-throughput prediction of finite-temperature properties using the quasi-harmonic approximation. (2024)

First Author: Pallikara I

Attributed to: HIGH END COMPUTING MATERIALS CHEMISTRY CONSORTIUM funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1088/1361-648x/ad19a3

PubMed Identifier: 38157557

Publication URI: http://europepmc.org/abstract/MED/38157557

Type: Journal Article/Review

Volume: 36

Parent Publication: Journal of physics. Condensed matter : an Institute of Physics journal

Issue: 20

ISSN: 0953-8984