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R-3m (166)
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Ab-initio phonon calculation for CdI2 / R-3m (166) / materials id 573588
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CdI2 / R-3m (166) / materials id 568233
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CdI2 / R-3m (166) / materials id 573608
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for CdI2 / R-3m (166) / materials id 568289
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
17/05/2023
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Dataset
4
Collection
MDR phonon calculation database
4
Keyword
CdI2
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4
Phonon
4
R-3m (166)
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4
Publisher
NIMS
4
Resource type
Dataset
4
Visibility
open
4
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
4
Data origin
simulation
4
Author
Atsushi Togo
4
Funder
MEXT
4
Software
VASP
4
phonopy
4
spglib
4