2 records found.
High-throughput computational screening of Heusler compounds with phonon considerations for enhanced material discovery
- Journal article
- Creator
-
Enda Xiao (author) (Search by this author)
https://orcid.org/0000-0002-4372-1575
(unauthenticated)
;
Terumasa Tadano (author) (Search by this author)
- Keyword
- Heusler alloys, High-throughput calculations, Phonon stability, Curie temperature, Compensated ferrimagnet
- Date published
- 2025-07-16
- Updated at
- 2025-09-11 12:30:19 +0900
Python suites for high-throughput calculations of the ab-initio quantum Monte Carlo methods
- Dataset
- Creator
-
NAKANO, Kosuke (author) (Search by this author)Center for Basic Research on Materials, National Institute for Materials Science (NIMS)
;
;Oto Kohulák (author) (Search by this author)International School for Advanced Studies (SISSA);Abhishek Raghav (author) (Search by this author)International School for Advanced Studies (SISSA);Michele Casula (author) (Search by this author)Institut de Minéralogie, de Physique des Matériaux et de Cosmochimie (IMPMC), Sorbonne UniversitéSandro Sorella (author) (Search by this author)International School for Advanced Studies (SISSA)
- Keyword
- Ab initio Quantum Monte Carlo, High-throughput calculations, TurboRVB, TurboGenius
- Date published
- Updated at
- 2023-11-15 15:38:36 +0900