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I4/mmm (139)
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Ab-initio phonon calculation for Nb2O5 / I4/mmm (139) / materials id 556048
Description/Abstract:
Ab-initio phonon calculation for Nb2O5 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
I4/mmm (139)
,
Nb2O5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Sm2Ti3(BiO6)2 / I4/mmm (139) / materials id 557438
Description/Abstract:
Ab-initio phonon calculation for Sm2Ti3(BiO6)2 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, a...
Keyword:
I4/mmm (139)
,
Phonon
, and
Sm2Ti3(BiO6)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BaSr3I8 / I4/mmm (139) / materials id 754736
Description/Abstract:
Ab-initio phonon calculation for BaSr3I8 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
BaSr3I8
,
I4/mmm (139)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2La2Ti3O10 / I4/mmm (139) / materials id 6144
Description/Abstract:
Ab-initio phonon calculation for Na2La2Ti3O10 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, an...
Keyword:
I4/mmm (139)
,
Na2La2Ti3O10
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for HgBr / I4/mmm (139) / materials id 23177
Description/Abstract:
Ab-initio phonon calculation for HgBr / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
HgBr
,
I4/mmm (139)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ba2ZrS4 / I4/mmm (139) / materials id 3813
Description/Abstract:
Ab-initio phonon calculation for Ba2ZrS4 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ba2ZrS4
,
I4/mmm (139)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Nd2TeO2 / I4/mmm (139) / materials id 5459
Description/Abstract:
Ab-initio phonon calculation for Nd2TeO2 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
I4/mmm (139)
,
Nd2TeO2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Tb2TeO2 / I4/mmm (139) / materials id 16036
Description/Abstract:
Ab-initio phonon calculation for Tb2TeO2 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
I4/mmm (139)
,
Phonon
, and
Tb2TeO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ba4Zr3S10 / I4/mmm (139) / materials id 14883
Description/Abstract:
Ab-initio phonon calculation for Ba4Zr3S10 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Ba4Zr3S10
,
I4/mmm (139)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2Nd2Ti3O10 / I4/mmm (139) / materials id 6119
Description/Abstract:
Ab-initio phonon calculation for Na2Nd2Ti3O10 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, an...
Keyword:
I4/mmm (139)
,
Na2Nd2Ti3O10
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
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Type of work
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146
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MDR phonon calculation database
146
Keyword
I4/mmm (139)
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146
Phonon
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4
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NIMS
146
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Creative Commons BY Attribution 4.0 International
146
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146
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Atsushi Togo
146
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MEXT
146
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VASP
146
phonopy
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spglib
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