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Pbca (61)
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Ab-initio phonon calculation for Ti(SiO3)2 / Pbca (61) / materials id 766596
Description/Abstract:
Ab-initio phonon calculation for Ti(SiO3)2 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Pbca (61)
,
Phonon
, and
Ti(SiO3)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaGa(TeO3)2 / Pbca (61) / materials id 554193
Description/Abstract:
Ab-initio phonon calculation for NaGa(TeO3)2 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
NaGa(TeO3)2
,
Pbca (61)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for HfO2 / Pbca (61) / materials id 1858
Description/Abstract:
Ab-initio phonon calculation for HfO2 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
HfO2
,
Pbca (61)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BiOF / Pbca (61) / materials id 759870
Description/Abstract:
Ab-initio phonon calculation for BiOF / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
BiOF
,
Pbca (61)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ba2Ti2Si2O9F2 / Pbca (61) / materials id 557968
Description/Abstract:
Ab-initio phonon calculation for Ba2Ti2Si2O9F2 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
Ba2Ti2Si2O9F2
,
Pbca (61)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Hg3TeCl4 / Pbca (61) / materials id 29102
Description/Abstract:
Ab-initio phonon calculation for Hg3TeCl4 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Hg3TeCl4
,
Pbca (61)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Pd(Se4Cl)2 / Pbca (61) / materials id 567437
Description/Abstract:
Ab-initio phonon calculation for Pd(Se4Cl)2 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Pbca (61)
,
Pd(Se4Cl)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaGaO2 / Pbca (61) / materials id 557154
Description/Abstract:
Ab-initio phonon calculation for NaGaO2 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
NaGaO2
,
Pbca (61)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ZnTeO3 / Pbca (61) / materials id 16819
Description/Abstract:
Ab-initio phonon calculation for ZnTeO3 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Pbca (61)
,
Phonon
, and
ZnTeO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K4PbO3 / Pbca (61) / materials id 21949
Description/Abstract:
Ab-initio phonon calculation for K4PbO3 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
K4PbO3
,
Pbca (61)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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Pbca (61)
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spglib
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