2 records found.
High-throughput computational screening of Heusler compounds with phonon considerations for enhanced material discovery
- Article
- Creator
-
Enda Xiao
;
Terumasa Tadano
- 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
;
Oto Kohulák
;
Abhishek Raghav
;
Michele Casula
;
Sandro Sorella
- Keyword
- Ab initio Quantum Monte Carlo, High-throughput calculations, TurboRVB, TurboGenius
- Date published
- Updated at
- 2023-11-15 15:38:36 +0900