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Cc (9)
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Ab-initio phonon calculation for LiZnPO4 / Cc (9) / materials id 555743
Description/Abstract:
Ab-initio phonon calculation for LiZnPO4 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Cc (9)
,
LiZnPO4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ga2S3 / Cc (9) / materials id 32616
Description/Abstract:
Ab-initio phonon calculation for Ga2S3 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw ...
Keyword:
Cc (9)
,
Ga2S3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Cu6PS5Br / Cc (9) / materials id 554627
Description/Abstract:
Ab-initio phonon calculation for Cu6PS5Br / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Cc (9)
,
Cu6PS5Br
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BaLi(BS2)3 / Cc (9) / materials id 557892
Description/Abstract:
Ab-initio phonon calculation for BaLi(BS2)3 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
BaLi(BS2)3
,
Cc (9)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Li5SiP3 / Cc (9) / materials id 685991
Description/Abstract:
Ab-initio phonon calculation for Li5SiP3 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Cc (9)
,
Li5SiP3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for In2Ag2GeS6 / Cc (9) / materials id 560386
Description/Abstract:
Ab-initio phonon calculation for In2Ag2GeS6 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Cc (9)
,
In2Ag2GeS6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CaAl4Si2(HO6)2 / Cc (9) / materials id 24469
Description/Abstract:
Ab-initio phonon calculation for CaAl4Si2(HO6)2 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
CaAl4Si2(HO6)2
,
Cc (9)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Ti3(BiO3)4 / Cc (9) / materials id 558277
Description/Abstract:
Ab-initio phonon calculation for Ti3(BiO3)4 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Cc (9)
,
Phonon
, and
Ti3(BiO3)4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for K2In(PSe4)2 / Cc (9) / materials id 581517
Description/Abstract:
Ab-initio phonon calculation for K2In(PSe4)2 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cc (9)
,
K2In(PSe4)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Si(Hg2S3)2 / Cc (9) / materials id 17948
Description/Abstract:
Ab-initio phonon calculation for Si(Hg2S3)2 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Cc (9)
,
Phonon
, and
Si(Hg2S3)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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82
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MDR phonon calculation database
82
Keyword
Cc (9)
[remove]
82
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82
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NIMS
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Creative Commons BY Attribution 4.0 International
82
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82
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Atsushi Togo
82
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MEXT
82
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VASP
82
phonopy
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spglib
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