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Pnma (62)
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Ab-initio phonon calculation for Dy3Se3N / Pnma (62) / materials id 567391
Description/Abstract:
Ab-initio phonon calculation for Dy3Se3N / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Dy3Se3N
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for TmCuPbSe3 / Pnma (62) / materials id 640324
Description/Abstract:
Ab-initio phonon calculation for TmCuPbSe3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Phonon
,
Pnma (62)
, and
TmCuPbSe3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for SrNd2O4 / Pnma (62) / materials id 755405
Description/Abstract:
Ab-initio phonon calculation for SrNd2O4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
SrNd2O4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for HoGaO3 / Pnma (62) / materials id 755416
Description/Abstract:
Ab-initio phonon calculation for HoGaO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
HoGaO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Tb2TiO5 / Pnma (62) / materials id 752414
Description/Abstract:
Ab-initio phonon calculation for Tb2TiO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
Tb2TiO5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for CdBiSe2Br / Pnma (62) / materials id 570590
Description/Abstract:
Ab-initio phonon calculation for CdBiSe2Br / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
CdBiSe2Br
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for NbPO5 / Pnma (62) / materials id 772125
Description/Abstract:
Ab-initio phonon calculation for NbPO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
NbPO5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Nb3O7F / Pnma (62) / materials id 760188
Description/Abstract:
Ab-initio phonon calculation for Nb3O7F / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Nb3O7F
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Bi3B5O12 / Pnma (62) / materials id 23549
Description/Abstract:
Ab-initio phonon calculation for Bi3B5O12 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Bi3B5O12
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for K2Te3 / Pnma (62) / materials id 7289
Description/Abstract:
Ab-initio phonon calculation for K2Te3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
K2Te3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
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839
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MDR phonon calculation database
839
Keyword
Phonon
839
Pnma (62)
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839
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839
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839
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
839
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simulation
839
Author
Atsushi Togo
839
Funder
MEXT
839
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VASP
839
phonopy
839
spglib
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