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Ab-initio phonon calculation for Cd3(PO4)2 / Cmce (64) / materials id 27600
Description/Abstract:
Ab-initio phonon calculation for Cd3(PO4)2 / Cmce (64) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Cd3(PO4)2
,
Cmce (64)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sr4As3 / Pbam (55) / materials id 29424
Description/Abstract:
Ab-initio phonon calculation for Sr4As3 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Pbam (55)
,
Phonon
, and
Sr4As3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for SrHfO3 / Pnma (62) / materials id 3378
Description/Abstract:
Ab-initio phonon calculation for SrHfO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
SrHfO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Hf(TeCl)6 / Pbcm (57) / materials id 31305
Description/Abstract:
Ab-initio phonon calculation for Hf(TeCl)6 / Pbcm (57) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Hf(TeCl)6
,
Pbcm (57)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Na2CuSbS3 / P2_1/c (14) / materials id 555871
Description/Abstract:
Ab-initio phonon calculation for Na2CuSbS3 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Na2CuSbS3
,
P2_1/c (14)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Y7TmO12 / I2_12_12_1 (24) / materials id 766267
Description/Abstract:
Ab-initio phonon calculation for Y7TmO12 / I2_12_12_1 (24) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
I2_12_12_1 (24)
,
Phonon
, and
Y7TmO12
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CaHClO / P6_3mc (186) / materials id 642725
Description/Abstract:
Ab-initio phonon calculation for CaHClO / P6_3mc (186) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
CaHClO
,
P6_3mc (186)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sr3AlSb3 / Cmce (64) / materials id 17667
Description/Abstract:
Ab-initio phonon calculation for Sr3AlSb3 / Cmce (64) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cmce (64)
,
Phonon
, and
Sr3AlSb3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for PrSc3(BO3)4 / C2/c (15) / materials id 18677
Description/Abstract:
Ab-initio phonon calculation for PrSc3(BO3)4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
Phonon
, and
PrSc3(BO3)4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Na4P2O7 / P2_12_12_1 (19) / materials id 27579
Description/Abstract:
Ab-initio phonon calculation for Na4P2O7 / P2_12_12_1 (19) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
Na4P2O7
,
P2_12_12_1 (19)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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