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Ibam (72)
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Ab-initio phonon calculation for K3InP2 / Ibam (72) / materials id 20256
Description/Abstract:
Ab-initio phonon calculation for K3InP2 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Ibam (72)
,
K3InP2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Cs2Zn3S4 / Ibam (72) / materials id 505633
Description/Abstract:
Ab-initio phonon calculation for Cs2Zn3S4 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cs2Zn3S4
,
Ibam (72)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Hg2PO3F / Ibam (72) / materials id 561472
Description/Abstract:
Ab-initio phonon calculation for Hg2PO3F / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Hg2PO3F
,
Ibam (72)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Cs2Li3GaO4 / Ibam (72) / materials id 555140
Description/Abstract:
Ab-initio phonon calculation for Cs2Li3GaO4 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Cs2Li3GaO4
,
Ibam (72)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Cs2Cd3Te4 / Ibam (72) / materials id 567386
Description/Abstract:
Ab-initio phonon calculation for Cs2Cd3Te4 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Cs2Cd3Te4
,
Ibam (72)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for BeCl2 / Ibam (72) / materials id 23267
Description/Abstract:
Ab-initio phonon calculation for BeCl2 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
BeCl2
,
Ibam (72)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for K2NaAlAs2 / Ibam (72) / materials id 9069
Description/Abstract:
Ab-initio phonon calculation for K2NaAlAs2 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ibam (72)
,
K2NaAlAs2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Na2ZnS2 / Ibam (72) / materials id 8257
Description/Abstract:
Ab-initio phonon calculation for Na2ZnS2 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ibam (72)
,
Na2ZnS2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for K4Ba(VS4)2 / Ibam (72) / materials id 558121
Description/Abstract:
Ab-initio phonon calculation for K4Ba(VS4)2 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ibam (72)
,
K4Ba(VS4)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for NaNb3O8 / Ibam (72) / materials id 14531
Description/Abstract:
Ab-initio phonon calculation for NaNb3O8 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ibam (72)
,
NaNb3O8
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
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61
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MDR phonon calculation database
61
Keyword
Ibam (72)
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61
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NIMS
61
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Rights Statement Sim
Creative Commons BY Attribution 4.0 International
61
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61
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Atsushi Togo
61
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MEXT
61
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VASP
61
phonopy
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spglib
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