4 records found.
Mechanism of Solid Ammonia Stabilization at Ambient Temperature: Insights from Thermodynamics, Phonon Calculation, and Micromechanics
- Article
- Creator
-
Masao Morishita
;
Terumasa Tadano
;
Yusuke Matsuoka
;
Taichi Abe
- Keyword
- Solid state ammonia, Phase stability, Thermodynanmics, Phonon calculation, Micromechanics, Hydrogen storage material
- Date published
- 2025-12-02
- Updated at
- 2025-12-05 16:30:15 +0900
Implementation strategies in phonopy and phono3py
- Article
- Creator
-
Atsushi Togo
;
Laurent Chaput
;
Terumasa Tadano
;
Isao Tanaka
- Keyword
- Phonon calculation
- Date published
- 2023-09-04
- Updated at
- 2024-01-05 22:11:26 +0900
LO-mode phonon of KCl and NaCl at 300 K by inelastic x-ray scattering measurements and first principles calculations
- Article
- Creator
-
Atsushi Togo
;
Hiroyuki Hayashi
;
Terumasa Tadano
;
Satoshi Tsutsui
;
Isao Tanaka
- Keyword
- Phonon calculation, IXS measurment
- Date published
- 2022-09-07
- Updated at
- 2024-01-05 22:12:13 +0900
First-principles phonon calculations with phonopy and phono3py
- Article
- Creator
-
Atsushi Togo
- Keyword
- Phonon calculation
- Date published
- 2023-01-15
- Updated at
- 2024-01-05 22:12:03 +0900