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Pnma (62)
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Ab-initio phonon calculation for Ba4LiNb3O12 / Pnma (62) / materials id 774715
Description/Abstract:
Ab-initio phonon calculation for Ba4LiNb3O12 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Ba4LiNb3O12
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Rb2PrCl5 / Pnma (62) / materials id 28275
Description/Abstract:
Ab-initio phonon calculation for Rb2PrCl5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pnma (62)
, and
Rb2PrCl5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for SnICl / Pnma (62) / materials id 571146
Description/Abstract:
Ab-initio phonon calculation for SnICl / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
Pnma (62)
, and
SnICl
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Ba2SiS4 / Pnma (62) / materials id 5838
Description/Abstract:
Ab-initio phonon calculation for Ba2SiS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ba2SiS4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NaPO3 / Pnma (62) / materials id 555118
Description/Abstract:
Ab-initio phonon calculation for NaPO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
NaPO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Cs2ZnCl4 / Pnma (62) / materials id 540578
Description/Abstract:
Ab-initio phonon calculation for Cs2ZnCl4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cs2ZnCl4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for LiCuS / Pnma (62) / materials id 753605
Description/Abstract:
Ab-initio phonon calculation for LiCuS / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
LiCuS
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Al3NO3 / Pnma (62) / materials id 675601
Description/Abstract:
Ab-initio phonon calculation for Al3NO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Al3NO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for SmInO3 / Pnma (62) / materials id 752437
Description/Abstract:
Ab-initio phonon calculation for SmInO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
SmInO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NaLiSe / Pnma (62) / materials id 28603
Description/Abstract:
Ab-initio phonon calculation for NaLiSe / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
NaLiSe
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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839
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MDR phonon calculation database
839
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Phonon
839
Pnma (62)
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839
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839
Rights Statement Sim
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839
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simulation
839
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Atsushi Togo
839
Funder
MEXT
839
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VASP
839
phonopy
839
spglib
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