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Atsushi Togo
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phonopy
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C2/m (12)
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Ab-initio phonon calculation for SrCO3 / C2/m (12) / materials id 33746
Description/Abstract:
Ab-initio phonon calculation for SrCO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/m (12)
,
Phonon
, and
SrCO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for As2Pb8O13 / C2/m (12) / materials id 31107
Description/Abstract:
Ab-initio phonon calculation for As2Pb8O13 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
As2Pb8O13
,
C2/m (12)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for K2Y4Cu4Se9 / C2/m (12) / materials id 867371
Description/Abstract:
Ab-initio phonon calculation for K2Y4Cu4Se9 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/m (12)
,
K2Y4Cu4Se9
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Tb3Si2Cl5O6 / C2/m (12) / materials id 555097
Description/Abstract:
Ab-initio phonon calculation for Tb3Si2Cl5O6 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/m (12)
,
Phonon
, and
Tb3Si2Cl5O6
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Hg3(SeI)2 / C2/m (12) / materials id 571404
Description/Abstract:
Ab-initio phonon calculation for Hg3(SeI)2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/m (12)
,
Hg3(SeI)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for HgPb2(ClO)2 / C2/m (12) / materials id 546862
Description/Abstract:
Ab-initio phonon calculation for HgPb2(ClO)2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/m (12)
,
HgPb2(ClO)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for TbBa2BiO6 / C2/m (12) / materials id 552191
Description/Abstract:
Ab-initio phonon calculation for TbBa2BiO6 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/m (12)
,
Phonon
, and
TbBa2BiO6
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for NaAgO2 / C2/m (12) / materials id 754326
Description/Abstract:
Ab-initio phonon calculation for NaAgO2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
NaAgO2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for SmTiClO3 / C2/m (12) / materials id 555184
Description/Abstract:
Ab-initio phonon calculation for SmTiClO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
Phonon
, and
SmTiClO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Zr4CdO9 / C2/m (12) / materials id 676286
Description/Abstract:
Ab-initio phonon calculation for Zr4CdO9 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/m (12)
,
Phonon
, and
Zr4CdO9
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
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MDR phonon calculation database
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C2/m (12)
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Atsushi Togo
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phonopy
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