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K2LiAlH6
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Ab-initio phonon calculation for K2LiAlH6 / Fm-3m (225) / materials id 24411
Description/Abstract:
Ab-initio phonon calculation for K2LiAlH6 / Fm-3m (225) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Fm-3m (225)
,
K2LiAlH6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K2LiAlH6 / R-3m (166) / materials id 23774
Description/Abstract:
Ab-initio phonon calculation for K2LiAlH6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
K2LiAlH6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
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Dataset
2
Collection
MDR phonon calculation database
2
Keyword
K2LiAlH6
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2
Phonon
2
Fm-3m (225)
1
R-3m (166)
1
Publisher
NIMS
2
Resource type
Dataset
2
Visibility
open
2
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
2
Data origin
simulation
2
Author
Atsushi Togo
2
Funder
MEXT
2
Software
VASP
2
phonopy
2
spglib
2