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Pnma (62)
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Ab-initio phonon calculation for Lu2GeO5 / Pnma (62) / materials id 768865
Description/Abstract:
Ab-initio phonon calculation for Lu2GeO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Lu2GeO5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Ba2TiS4 / Pnma (62) / materials id 17908
Description/Abstract:
Ab-initio phonon calculation for Ba2TiS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ba2TiS4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Li2CdSiO4 / Pnma (62) / materials id 557293
Description/Abstract:
Ab-initio phonon calculation for Li2CdSiO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Li2CdSiO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for YCuS2 / Pnma (62) / materials id 10533
Description/Abstract:
Ab-initio phonon calculation for YCuS2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
Pnma (62)
, and
YCuS2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Ba(YTe2)2 / Pnma (62) / materials id 17872
Description/Abstract:
Ab-initio phonon calculation for Ba(YTe2)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ba(YTe2)2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Sr3TaAs3O / Pnma (62) / materials id 18199
Description/Abstract:
Ab-initio phonon calculation for Sr3TaAs3O / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Phonon
,
Pnma (62)
, and
Sr3TaAs3O
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Rb2Cd3S4 / Pnma (62) / materials id 18556
Description/Abstract:
Ab-initio phonon calculation for Rb2Cd3S4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pnma (62)
, and
Rb2Cd3S4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for TaNbO5 / Pnma (62) / materials id 756127
Description/Abstract:
Ab-initio phonon calculation for TaNbO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
TaNbO5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for La3TiCl5O4 / Pnma (62) / materials id 556659
Description/Abstract:
Ab-initio phonon calculation for La3TiCl5O4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
La3TiCl5O4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for K2SnO3 / Pnma (62) / materials id 17730
Description/Abstract:
Ab-initio phonon calculation for K2SnO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
K2SnO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
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839
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MDR phonon calculation database
839
Keyword
Phonon
839
Pnma (62)
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839
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Rights Statement Sim
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839
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839
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Atsushi Togo
839
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MEXT
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VASP
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phonopy
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