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Pn-3m (224)
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Ab-initio phonon calculation for HoAl3(PbO4)2 / Pn-3m (224) / materials id 8888
Description/Abstract:
Ab-initio phonon calculation for HoAl3(PbO4)2 / Pn-3m (224) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
HoAl3(PbO4)2
,
Phonon
, and
Pn-3m (224)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for SmAl3(PbO4)2 / Pn-3m (224) / materials id 21567
Description/Abstract:
Ab-initio phonon calculation for SmAl3(PbO4)2 / Pn-3m (224) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
Phonon
,
Pn-3m (224)
, and
SmAl3(PbO4)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Cu2O / Pn-3m (224) / materials id 361
Description/Abstract:
Ab-initio phonon calculation for Cu2O / Pn-3m (224) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Cu2O
,
Phonon
, and
Pn-3m (224)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for NdAl3(PbO4)2 / Pn-3m (224) / materials id 21618
Description/Abstract:
Ab-initio phonon calculation for NdAl3(PbO4)2 / Pn-3m (224) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
NdAl3(PbO4)2
,
Phonon
, and
Pn-3m (224)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for LuAl3(PbO4)2 / Pn-3m (224) / materials id 14760
Description/Abstract:
Ab-initio phonon calculation for LuAl3(PbO4)2 / Pn-3m (224) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
LuAl3(PbO4)2
,
Phonon
, and
Pn-3m (224)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
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MDR phonon calculation database
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Phonon
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Pn-3m (224)
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NIMS
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Rights Statement Sim
Creative Commons BY Attribution 4.0 International
5
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Atsushi Togo
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Funder
MEXT
5
Software
VASP
5
phonopy
5
spglib
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