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I4/mmm (139)
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Ab-initio phonon calculation for Rb2CdCl4 / I4/mmm (139) / materials id 29873
Description/Abstract:
Ab-initio phonon calculation for Rb2CdCl4 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
I4/mmm (139)
,
Phonon
, and
Rb2CdCl4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for K2La2Ti3O10 / I4/mmm (139) / materials id 6548
Description/Abstract:
Ab-initio phonon calculation for K2La2Ti3O10 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
I4/mmm (139)
,
K2La2Ti3O10
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for KCuO / I4/mmm (139) / materials id 7911
Description/Abstract:
Ab-initio phonon calculation for KCuO / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
I4/mmm (139)
,
KCuO
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Dy2SeO2 / I4/mmm (139) / materials id 769253
Description/Abstract:
Ab-initio phonon calculation for Dy2SeO2 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Dy2SeO2
,
I4/mmm (139)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for TmF3 / I4/mmm (139) / materials id 865194
Description/Abstract:
Ab-initio phonon calculation for TmF3 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
I4/mmm (139)
,
Phonon
, and
TmF3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sr2ZnN2 / I4/mmm (139) / materials id 9306
Description/Abstract:
Ab-initio phonon calculation for Sr2ZnN2 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
I4/mmm (139)
,
Phonon
, and
Sr2ZnN2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Yb4As2O / I4/mmm (139) / materials id 9799
Description/Abstract:
Ab-initio phonon calculation for Yb4As2O / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
I4/mmm (139)
,
Phonon
, and
Yb4As2O
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Cs3TlF6 / I4/mmm (139) / materials id 561827
Description/Abstract:
Ab-initio phonon calculation for Cs3TlF6 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Cs3TlF6
,
I4/mmm (139)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Ba3Hf2O7 / I4/mmm (139) / materials id 754128
Description/Abstract:
Ab-initio phonon calculation for Ba3Hf2O7 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Ba3Hf2O7
,
I4/mmm (139)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for CsAuI3 / I4/mmm (139) / materials id 28453
Description/Abstract:
Ab-initio phonon calculation for CsAuI3 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
CsAuI3
,
I4/mmm (139)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
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146
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MDR phonon calculation database
146
Keyword
I4/mmm (139)
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146
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146
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Atsushi Togo
146
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MEXT
146
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VASP
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phonopy
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spglib
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