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Cmcm (63)
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Ab-initio phonon calculation for SrLi2Ta2O7 / Cmcm (63) / materials id 558054
Description/Abstract:
Ab-initio phonon calculation for SrLi2Ta2O7 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Cmcm (63)
,
Phonon
, and
SrLi2Ta2O7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for BaU(SiO4)2 / Cmcm (63) / materials id 555561
Description/Abstract:
Ab-initio phonon calculation for BaU(SiO4)2 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
BaU(SiO4)2
,
Cmcm (63)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for SiO2 / Cmcm (63) / materials id 600039
Description/Abstract:
Ab-initio phonon calculation for SiO2 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Cmcm (63)
,
Phonon
, and
SiO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for KAlH2CO5 / Cmcm (63) / materials id 644285
Description/Abstract:
Ab-initio phonon calculation for KAlH2CO5 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cmcm (63)
,
KAlH2CO5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Sn2IF3 / Cmcm (63) / materials id 555077
Description/Abstract:
Ab-initio phonon calculation for Sn2IF3 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Cmcm (63)
,
Phonon
, and
Sn2IF3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for InI / Cmcm (63) / materials id 23202
Description/Abstract:
Ab-initio phonon calculation for InI / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Cmcm (63)
,
InI
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for CsErZnTe3 / Cmcm (63) / materials id 569107
Description/Abstract:
Ab-initio phonon calculation for CsErZnTe3 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Cmcm (63)
,
CsErZnTe3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Cs2LiCl3 / Cmcm (63) / materials id 571390
Description/Abstract:
Ab-initio phonon calculation for Cs2LiCl3 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cmcm (63)
,
Cs2LiCl3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CsSmZnSe3 / Cmcm (63) / materials id 505709
Description/Abstract:
Ab-initio phonon calculation for CsSmZnSe3 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Cmcm (63)
,
CsSmZnSe3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CsTm2Cu3Se5 / Cmcm (63) / materials id 581749
Description/Abstract:
Ab-initio phonon calculation for CsTm2Cu3Se5 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Cmcm (63)
,
CsTm2Cu3Se5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
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MDR phonon calculation database
301
Keyword
Cmcm (63)
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301
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301
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Atsushi Togo
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301
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phonopy
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spglib
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