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Cmc2_1 (36)
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Ab-initio phonon calculation for Nb2Bi2PbO9 / Cmc2_1 (36) / materials id 583454
Description/Abstract:
Ab-initio phonon calculation for Nb2Bi2PbO9 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Cmc2_1 (36)
,
Nb2Bi2PbO9
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for BrF3 / Cmc2_1 (36) / materials id 23297
Description/Abstract:
Ab-initio phonon calculation for BrF3 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
BrF3
,
Cmc2_1 (36)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NbI4 / Cmc2_1 (36) / materials id 570044
Description/Abstract:
Ab-initio phonon calculation for NbI4 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Cmc2_1 (36)
,
NbI4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Al5BO9 / Cmc2_1 (36) / materials id 3281
Description/Abstract:
Ab-initio phonon calculation for Al5BO9 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Al5BO9
,
Cmc2_1 (36)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for SrTa2Bi2O9 / Cmc2_1 (36) / materials id 23089
Description/Abstract:
Ab-initio phonon calculation for SrTa2Bi2O9 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Cmc2_1 (36)
,
Phonon
, and
SrTa2Bi2O9
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for RbHO / Cmc2_1 (36) / materials id 626620
Description/Abstract:
Ab-initio phonon calculation for RbHO / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Cmc2_1 (36)
,
Phonon
, and
RbHO
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Sr2CdAs2 / Cmc2_1 (36) / materials id 867203
Description/Abstract:
Ab-initio phonon calculation for Sr2CdAs2 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Cmc2_1 (36)
,
Phonon
, and
Sr2CdAs2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb2SnO3 / Cmc2_1 (36) / materials id 753798
Description/Abstract:
Ab-initio phonon calculation for Rb2SnO3 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Cmc2_1 (36)
,
Phonon
, and
Rb2SnO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for B2O3 / Cmc2_1 (36) / materials id 717
Description/Abstract:
Ab-initio phonon calculation for B2O3 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
B2O3
,
Cmc2_1 (36)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2SiO3 / Cmc2_1 (36) / materials id 4533
Description/Abstract:
Ab-initio phonon calculation for Na2SiO3 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Cmc2_1 (36)
,
Na2SiO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
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108
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MDR phonon calculation database
108
Keyword
Cmc2_1 (36)
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108
Phonon
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NIMS
108
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108
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108
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Atsushi Togo
108
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MEXT
108
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VASP
108
phonopy
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spglib
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