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Ab-initio phonon calculation for Rb2Hg2PdCl8 / C2/m (12) / materials id 568252
Description/Abstract:
Ab-initio phonon calculation for Rb2Hg2PdCl8 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/m (12)
,
Phonon
, and
Rb2Hg2PdCl8
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for InBr3 / C2/m (12) / materials id 570219
Description/Abstract:
Ab-initio phonon calculation for InBr3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/m (12)
,
InBr3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Pr2O3 / C2/m (12) / materials id 555159
Description/Abstract:
Ab-initio phonon calculation for Pr2O3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/m (12)
,
Phonon
, and
Pr2O3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KLaPdO3 / C2/m (12) / materials id 556475
Description/Abstract:
Ab-initio phonon calculation for KLaPdO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/m (12)
,
KLaPdO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiNbO3 / C2/m (12) / materials id 755559
Description/Abstract:
Ab-initio phonon calculation for LiNbO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
LiNbO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for InSe / C2/m (12) / materials id 21405
Description/Abstract:
Ab-initio phonon calculation for InSe / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
C2/m (12)
,
InSe
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KHo2F7 / C2/m (12) / materials id 31030
Description/Abstract:
Ab-initio phonon calculation for KHo2F7 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
KHo2F7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Ta6Pb4O19 / C2/m (12) / materials id 685995
Description/Abstract:
Ab-initio phonon calculation for Ta6Pb4O19 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/m (12)
,
Phonon
, and
Ta6Pb4O19
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for U(SbO3)2 / C2/m (12) / materials id 31256
Description/Abstract:
Ab-initio phonon calculation for U(SbO3)2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
Phonon
, and
U(SbO3)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Hf3Tl2(CuSe4)2 / C2/m (12) / materials id 570700
Description/Abstract:
Ab-initio phonon calculation for Hf3Tl2(CuSe4)2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
C2/m (12)
,
Hf3Tl2(CuSe4)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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368
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MDR phonon calculation database
368
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C2/m (12)
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Atsushi Togo
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phonopy
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