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Ab-initio phonon calculation for CsGeCl3 / R3m (160) / materials id 22988
Description/Abstract:
Ab-initio phonon calculation for CsGeCl3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CsGeCl3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for AgNO3 / R3m (160) / materials id 8196
Description/Abstract:
Ab-initio phonon calculation for AgNO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
AgNO3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 555410
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for MoS2 / R3m (160) / materials id 1434
Description/Abstract:
Ab-initio phonon calculation for MoS2 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
MoS2
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for KAl11O17 / R3m (160) / materials id 760755
Description/Abstract:
Ab-initio phonon calculation for KAl11O17 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
KAl11O17
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for MgAl10O16 / R3m (160) / materials id 757911
Description/Abstract:
Ab-initio phonon calculation for MgAl10O16 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
MgAl10O16
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for BaCO3 / R3m (160) / materials id 4559
Description/Abstract:
Ab-initio phonon calculation for BaCO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
BaCO3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 18377
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for InSe / R3m (160) / materials id 22691
Description/Abstract:
Ab-initio phonon calculation for InSe / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
InSe
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for K3B6BrO10 / R3m (160) / materials id 23612
Description/Abstract:
Ab-initio phonon calculation for K3B6BrO10 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
K3B6BrO10
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
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MDR phonon calculation database
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Phonon
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Atsushi Togo
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