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C2/m (12)
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Ab-initio phonon calculation for Li2HfO3 / C2/m (12) / materials id 756597
Description/Abstract:
Ab-initio phonon calculation for Li2HfO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/m (12)
,
Li2HfO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NaSbS2 / C2/m (12) / materials id 557179
Description/Abstract:
Ab-initio phonon calculation for NaSbS2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
NaSbS2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for LiN3 / C2/m (12) / materials id 2659
Description/Abstract:
Ab-initio phonon calculation for LiN3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
C2/m (12)
,
LiN3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for GaCl3 / C2/m (12) / materials id 30952
Description/Abstract:
Ab-initio phonon calculation for GaCl3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/m (12)
,
GaCl3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sc2S3 / C2/m (12) / materials id 684969
Description/Abstract:
Ab-initio phonon calculation for Sc2S3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/m (12)
,
Phonon
, and
Sc2S3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sm2Ge2O7 / C2/m (12) / materials id 754621
Description/Abstract:
Ab-initio phonon calculation for Sm2Ge2O7 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
Phonon
, and
Sm2Ge2O7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Te3As2 / C2/m (12) / materials id 484
Description/Abstract:
Ab-initio phonon calculation for Te3As2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
Phonon
, and
Te3As2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Rb3YO3 / C2/m (12) / materials id 754146
Description/Abstract:
Ab-initio phonon calculation for Rb3YO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
Phonon
, and
Rb3YO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for P2Pb8O13 / C2/m (12) / materials id 31069
Description/Abstract:
Ab-initio phonon calculation for P2Pb8O13 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
P2Pb8O13
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Cs3YO3 / C2/m (12) / materials id 755541
Description/Abstract:
Ab-initio phonon calculation for Cs3YO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
Cs3YO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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368
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MDR phonon calculation database
368
Keyword
C2/m (12)
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Phonon
368
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NIMS
368
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368
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simulation
368
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Atsushi Togo
368
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MEXT
368
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VASP
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368
phonopy
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