6 records found. Displaying records 1 to 6.
Control of twin boundary mobility by solute segregation in Mg binary alloys
- Journal article
- Creator
-
Hidetoshi Somekawa (author) (Search by this author)National Institute for Materials Science
;
;Tomohito Tsuru (author) (Search by this author)Kimiyoshi Naito (author) (Search by this author)National Institute for Materials Science
;
Alok Singh (author) (Search by this author)National Institute for Materials Science
- Keyword
- Magnesium alloy, Segregation, Deformation twinning, Damping capacity, First-principles calculation
- Date published
- 2024-05-20
- Updated at
- 2024-08-22 13:58:45 +0900
Role of atypical temperature-responsive lattice thermal transport on the thermoelectric properties of antiperovskites Mg3XN (X = P, As, Sb, Bi)
- Journal article
- Creator
-
;Jincheng Yue (author) (Search by this author);Yanhui Liu (author) (Search by this author);Wenling Ren (author) (Search by this author);Shuyao Lin (author) (Search by this author);Chen Shen (author) (Search by this author);Harish Kumar Singh (author) (Search by this author);Tian Cui (author) (Search by this author)Terumasa Tadano (author) (Search by this author)National Institute for Materials Science
;
Hongbin Zhang (author) (Search by this author)
- Keyword
- Antiperovskite, First-principles calculation, Four-phonon scattering, Self-consistent phonon theory, Thermoelectric properties, Anharmonicity
- Date published
- 2024-01-25
- Updated at
- 2026-01-24 12:30:21 +0900
Grain boundary plasticity in Mg binary alloys by segregation of p-block element
- Journal article
- Creator
-
Hidetoshi Somekawa (author) (Search by this author)National Institute for Materials Science
;
;Tomohito Tsuru (author) (Search by this author)Alok Singh (author) (Search by this author)National Institute for Materials Science
- Keyword
- Magnesium alloy, Grain boundary segregation, First-principles calculation, Deformation mechanism
- Date published
- 2024-01-01
- Updated at
- 2024-10-25 10:02:38 +0900
Accurate screening of functional materials with machine-learning potential and transfer-learned regressions: Heusler alloy benchmark
- 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, Machine-learning potential, Transfer learning, First-principles calculation, Curie temperature, Magnetic anisotropy energy
- Date published
- 2026-02-19
- Updated at
- 2026-03-30 13:06:06 +0900
First-principles Calculations of Optical Energy Loss Functions for 30 Compound and 5 Elemental Semiconductors
- Journal article
- Creator
-
Hiroshi Shinotsuka (author) (Search by this author)National Institute for Materials Science
;
Hideki Yoshikawa (author) (Search by this author)National Institute for Materials Science
;
Shigeo Tanuma (author) (Search by this author)National Institute for Materials Science
- Keyword
- Energy loss function, Optical constant, First-principles calculation, Compound semiconductor, Inelastic mean free paths
- Date published
- 2021-07-15
- Updated at
- 2026-02-04 12:30:04 +0900
Examples of SQS (special quasirandom structure) models for arbitrary binary bcc (body centered cubic) and hcp (hexagonal close packed) structures
- Dataset
- Creator
-
SAHARA, Ryoji (author) (Search by this author)
- Keyword
- Sommerfeld model, quasi-harmonic vibrational contribution, First-principles calculation, Debye model, titanium alloys
- Date published
- 2020-10-15
- Updated at
- 2024-01-05 22:12:16 +0900