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P-4m2 (115)
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Ab-initio phonon calculation for SiO2 / P-4m2 (115) / materials id 600001
Description/Abstract:
Ab-initio phonon calculation for SiO2 / P-4m2 (115) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
P-4m2 (115)
,
Phonon
, and
SiO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ZnCdS2 / P-4m2 (115) / materials id 971712
Description/Abstract:
Ab-initio phonon calculation for ZnCdS2 / P-4m2 (115) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
P-4m2 (115)
,
Phonon
, and
ZnCdS2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Ca(AuF6)2 / P-4m2 (115) / materials id 28153
Description/Abstract:
Ab-initio phonon calculation for Ca(AuF6)2 / P-4m2 (115) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Ca(AuF6)2
,
P-4m2 (115)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for K4Nb8Si(P2O17)2 / P-4m2 (115) / materials id 14873
Description/Abstract:
Ab-initio phonon calculation for K4Nb8Si(P2O17)2 / P-4m2 (115) Phonon band structure, phonon DOS, thermal properties at constant volume, ...
Keyword:
K4Nb8Si(P2O17)2
,
P-4m2 (115)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for CsLi2I3 / P-4m2 (115) / materials id 569055
Description/Abstract:
Ab-initio phonon calculation for CsLi2I3 / P-4m2 (115) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
CsLi2I3
,
P-4m2 (115)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
17/05/2023
Ab-initio phonon calculation for Nd2Th8O19 / P-4m2 (115) / materials id 676552
Description/Abstract:
Ab-initio phonon calculation for Nd2Th8O19 / P-4m2 (115) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Nd2Th8O19
,
P-4m2 (115)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Sm2Th8O19 / P-4m2 (115) / materials id 676629
Description/Abstract:
Ab-initio phonon calculation for Sm2Th8O19 / P-4m2 (115) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
P-4m2 (115)
,
Phonon
, and
Sm2Th8O19
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for La2Th8O19 / P-4m2 (115) / materials id 675564
Description/Abstract:
Ab-initio phonon calculation for La2Th8O19 / P-4m2 (115) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
La2Th8O19
,
P-4m2 (115)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
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MDR phonon calculation database
8
Keyword
P-4m2 (115)
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Phonon
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CsLi2I3
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NIMS
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Creative Commons BY Attribution 4.0 International
8
Data origin
simulation
8
Author
Atsushi Togo
8
Funder
MEXT
8
Software
VASP
8
phonopy
8
spglib
8