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Ab-initio phonon calculation for Na4Li5(BO3)3 / C2/c (15) / materials id 558455
Description/Abstract:
Ab-initio phonon calculation for Na4Li5(BO3)3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
C2/c (15)
,
Na4Li5(BO3)3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Cu4Bi4S9 / Pnma (62) / materials id 559551
Description/Abstract:
Ab-initio phonon calculation for Cu4Bi4S9 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cu4Bi4S9
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Er2Be2GeO7 / P-42_1m (113) / materials id 14420
Description/Abstract:
Ab-initio phonon calculation for Er2Be2GeO7 / P-42_1m (113) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
Er2Be2GeO7
,
P-42_1m (113)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CdI2 / P3m1 (156) / materials id 680115
Description/Abstract:
Ab-initio phonon calculation for CdI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
P3m1 (156)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K2ZnTe2 / Ibam (72) / materials id 12535
Description/Abstract:
Ab-initio phonon calculation for K2ZnTe2 / Ibam (72) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ibam (72)
,
K2ZnTe2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CsAg2AsS3 / P2_1/c (14) / materials id 866615
Description/Abstract:
Ab-initio phonon calculation for CsAg2AsS3 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
CsAg2AsS3
,
P2_1/c (14)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ZrTe2Br5 / C2/m (12) / materials id 28671
Description/Abstract:
Ab-initio phonon calculation for ZrTe2Br5 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
Phonon
, and
ZrTe2Br5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Mg2TiO4 / P4_122 (91) / materials id 757031
Description/Abstract:
Ab-initio phonon calculation for Mg2TiO4 / P4_122 (91) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Mg2TiO4
,
P4_122 (91)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na3CuO3 / Cmce (64) / materials id 28556
Description/Abstract:
Ab-initio phonon calculation for Na3CuO3 / Cmce (64) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Cmce (64)
,
Na3CuO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for PrBi2BrO4 / P4/mmm (123) / materials id 551900
Description/Abstract:
Ab-initio phonon calculation for PrBi2BrO4 / P4/mmm (123) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
P4/mmm (123)
,
Phonon
, and
PrBi2BrO4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
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