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Pnma (62)
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Ab-initio phonon calculation for Y3Si2ClO8 / Pnma (62) / materials id 558883
Description/Abstract:
Ab-initio phonon calculation for Y3Si2ClO8 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Phonon
,
Pnma (62)
, and
Y3Si2ClO8
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BiOF / Pnma (62) / materials id 759825
Description/Abstract:
Ab-initio phonon calculation for BiOF / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
BiOF
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Al3Bi5I12 / Pnma (62) / materials id 645326
Description/Abstract:
Ab-initio phonon calculation for Al3Bi5I12 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Al3Bi5I12
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KPPbS4 / Pnma (62) / materials id 638150
Description/Abstract:
Ab-initio phonon calculation for KPPbS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KPPbS4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Sb2Se3 / Pnma (62) / materials id 2160
Description/Abstract:
Ab-initio phonon calculation for Sb2Se3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
Sb2Se3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K2PrCl5 / Pnma (62) / materials id 569967
Description/Abstract:
Ab-initio phonon calculation for K2PrCl5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
K2PrCl5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for TbLi4F8 / Pnma (62) / materials id 505089
Description/Abstract:
Ab-initio phonon calculation for TbLi4F8 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
TbLi4F8
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Lu3TaO7 / Pnma (62) / materials id 779145
Description/Abstract:
Ab-initio phonon calculation for Lu3TaO7 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Lu3TaO7
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CaPbO3 / Pnma (62) / materials id 20079
Description/Abstract:
Ab-initio phonon calculation for CaPbO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CaPbO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BiSeCl / Pnma (62) / materials id 610491
Description/Abstract:
Ab-initio phonon calculation for BiSeCl / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
BiSeCl
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
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839
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MDR phonon calculation database
839
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Phonon
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Pnma (62)
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839
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839
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839
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Atsushi Togo
839
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MEXT
839
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phonopy
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