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C2/m (12)
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Ab-initio phonon calculation for BaHf(PO4)2 / C2/m (12) / materials id 545548
Description/Abstract:
Ab-initio phonon calculation for BaHf(PO4)2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
BaHf(PO4)2
,
C2/m (12)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BiBr / C2/m (12) / materials id 568758
Description/Abstract:
Ab-initio phonon calculation for BiBr / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
BiBr
,
C2/m (12)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CsHg5Cl11 / C2/m (12) / materials id 568628
Description/Abstract:
Ab-initio phonon calculation for CsHg5Cl11 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/m (12)
,
CsHg5Cl11
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Nb3Tl2Br9 / C2/m (12) / materials id 541709
Description/Abstract:
Ab-initio phonon calculation for Nb3Tl2Br9 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/m (12)
,
Nb3Tl2Br9
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Bi3Se4Br / C2/m (12) / materials id 29857
Description/Abstract:
Ab-initio phonon calculation for Bi3Se4Br / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Bi3Se4Br
,
C2/m (12)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for RbAuI3 / C2/m (12) / materials id 568666
Description/Abstract:
Ab-initio phonon calculation for RbAuI3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
Phonon
, and
RbAuI3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Nd3PO7 / C2/m (12) / materials id 29094
Description/Abstract:
Ab-initio phonon calculation for Nd3PO7 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
Nd3PO7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ZrTe2Br5 / C2/m (12) / materials id 28671
Description/Abstract:
Ab-initio phonon calculation for ZrTe2Br5 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
Phonon
, and
ZrTe2Br5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for YBr3 / C2/m (12) / materials id 754815
Description/Abstract:
Ab-initio phonon calculation for YBr3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
C2/m (12)
,
Phonon
, and
YBr3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ThTa2O7 / C2/m (12) / materials id 28611
Description/Abstract:
Ab-initio phonon calculation for ThTa2O7 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/m (12)
,
Phonon
, and
ThTa2O7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
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MDR phonon calculation database
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C2/m (12)
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phonopy
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