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361.
Ab-initio phonon calculation for CsAg3S2 / C2/m (12) / materials id 561902
Description/Abstract:
Ab-initio phonon calculation for CsAg3S2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/m (12)
,
CsAg3S2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
362.
Ab-initio phonon calculation for Zn2(PS3)3 / C2/m (12) / materials id 27656
Description/Abstract:
Ab-initio phonon calculation for Zn2(PS3)3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/m (12)
,
Phonon
, and
Zn2(PS3)3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
363.
Ab-initio phonon calculation for Cs2Li3Br5 / C2/m (12) / materials id 571409
Description/Abstract:
Ab-initio phonon calculation for Cs2Li3Br5 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/m (12)
,
Cs2Li3Br5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
364.
Ab-initio phonon calculation for Ag2S / C2/m (12) / materials id 32884
Description/Abstract:
Ab-initio phonon calculation for Ag2S / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Ag2S
,
C2/m (12)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
365.
Ab-initio phonon calculation for In2Si2O7 / C2/m (12) / materials id 2874
Description/Abstract:
Ab-initio phonon calculation for In2Si2O7 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
In2Si2O7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
366.
Ab-initio phonon calculation for Ca5P8 / C2/m (12) / materials id 28879
Description/Abstract:
Ab-initio phonon calculation for Ca5P8 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/m (12)
,
Ca5P8
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
367.
Ab-initio phonon calculation for Rb3AlO3 / C2/m (12) / materials id 14951
Description/Abstract:
Ab-initio phonon calculation for Rb3AlO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/m (12)
,
Phonon
, and
Rb3AlO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
368.
Ab-initio phonon calculation for K2Ti8O17 / C2/m (12) / materials id 762279
Description/Abstract:
Ab-initio phonon calculation for K2Ti8O17 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
K2Ti8O17
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
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MDR phonon calculation database
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C2/m (12)
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368
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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
368
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