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Amm2 (38)
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Ab-initio phonon calculation for ZrPbO3 / Amm2 (38) / materials id 20337
Description/Abstract:
Ab-initio phonon calculation for ZrPbO3 / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Amm2 (38)
,
Phonon
, and
ZrPbO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for SrNb6O16 / Amm2 (38) / materials id 14482
Description/Abstract:
Ab-initio phonon calculation for SrNb6O16 / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Amm2 (38)
,
Phonon
, and
SrNb6O16
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K4BaTa6(Si2O13)2 / Amm2 (38) / materials id 677011
Description/Abstract:
Ab-initio phonon calculation for K4BaTa6(Si2O13)2 / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, a...
Keyword:
Amm2 (38)
,
K4BaTa6(Si2O13)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb6Si10O23 / Amm2 (38) / materials id 27376
Description/Abstract:
Ab-initio phonon calculation for Rb6Si10O23 / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Amm2 (38)
,
Phonon
, and
Rb6Si10O23
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BaTa6O16 / Amm2 (38) / materials id 769349
Description/Abstract:
Ab-initio phonon calculation for BaTa6O16 / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Amm2 (38)
,
BaTa6O16
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for CsH3O2 / Amm2 (38) / materials id 626417
Description/Abstract:
Ab-initio phonon calculation for CsH3O2 / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Amm2 (38)
,
CsH3O2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for LiB6C / Amm2 (38) / materials id 569450
Description/Abstract:
Ab-initio phonon calculation for LiB6C / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Amm2 (38)
,
LiB6C
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Na3La2(BO3)3 / Amm2 (38) / materials id 560129
Description/Abstract:
Ab-initio phonon calculation for Na3La2(BO3)3 / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Amm2 (38)
,
Na3La2(BO3)3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for K3ClO / Amm2 (38) / materials id 673798
Description/Abstract:
Ab-initio phonon calculation for K3ClO / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Amm2 (38)
,
K3ClO
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
17/05/2023
Ab-initio phonon calculation for KNbO3 / Amm2 (38) / materials id 5246
Description/Abstract:
Ab-initio phonon calculation for KNbO3 / Amm2 (38) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Amm2 (38)
,
KNbO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
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MDR phonon calculation database
16
Keyword
Amm2 (38)
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Phonon
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BaTa6O16
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Rights Statement Sim
Creative Commons BY Attribution 4.0 International
16
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16
Author
Atsushi Togo
16
Funder
MEXT
16
Software
VASP
16
phonopy
16
spglib
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