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Fddd (70)
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Ab-initio phonon calculation for Ba(InS2)2 / Fddd (70) / materials id 21943
Description/Abstract:
Ab-initio phonon calculation for Ba(InS2)2 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ba(InS2)2
,
Fddd (70)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb2NbAgS4 / Fddd (70) / materials id 14636
Description/Abstract:
Ab-initio phonon calculation for Rb2NbAgS4 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Fddd (70)
,
Phonon
, and
Rb2NbAgS4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for InOF / Fddd (70) / materials id 27175
Description/Abstract:
Ab-initio phonon calculation for InOF / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Fddd (70)
,
InOF
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ag2SO4 / Fddd (70) / materials id 5625
Description/Abstract:
Ab-initio phonon calculation for Ag2SO4 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Ag2SO4
,
Fddd (70)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb2Pd3Se4 / Fddd (70) / materials id 14340
Description/Abstract:
Ab-initio phonon calculation for Rb2Pd3Se4 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Fddd (70)
,
Phonon
, and
Rb2Pd3Se4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb2NbAgSe4 / Fddd (70) / materials id 9764
Description/Abstract:
Ab-initio phonon calculation for Rb2NbAgSe4 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Fddd (70)
,
Phonon
, and
Rb2NbAgSe4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ca(AlS2)2 / Fddd (70) / materials id 14422
Description/Abstract:
Ab-initio phonon calculation for Ca(AlS2)2 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ca(AlS2)2
,
Fddd (70)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Cs2NbAgSe4 / Fddd (70) / materials id 14637
Description/Abstract:
Ab-initio phonon calculation for Cs2NbAgSe4 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Cs2NbAgSe4
,
Fddd (70)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ag2SeO4 / Fddd (70) / materials id 11641
Description/Abstract:
Ab-initio phonon calculation for Ag2SeO4 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ag2SeO4
,
Fddd (70)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Na2SO4 / Fddd (70) / materials id 4770
Description/Abstract:
Ab-initio phonon calculation for Na2SO4 / Fddd (70) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Fddd (70)
,
Na2SO4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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62
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MDR phonon calculation database
62
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Fddd (70)
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62
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62
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Atsushi Togo
62
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MEXT
62
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VASP
62
phonopy
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spglib
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