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Ab-initio phonon calculation for YbB4O7 / Pmn2_1 (31) / materials id 752484
Description/Abstract:
Ab-initio phonon calculation for YbB4O7 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pmn2_1 (31)
, and
YbB4O7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Ba2Si5N8 / Pmn2_1 (31) / materials id 9711
Description/Abstract:
Ab-initio phonon calculation for Ba2Si5N8 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ba2Si5N8
,
Phonon
, and
Pmn2_1 (31)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for CsIO3 / Pmn2_1 (31) / materials id 28295
Description/Abstract:
Ab-initio phonon calculation for CsIO3 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CsIO3
,
Phonon
, and
Pmn2_1 (31)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for GaHO2 / Pmn2_1 (31) / materials id 23803
Description/Abstract:
Ab-initio phonon calculation for GaHO2 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
GaHO2
,
Phonon
, and
Pmn2_1 (31)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Cd2GaAgS4 / Pmn2_1 (31) / materials id 6356
Description/Abstract:
Ab-initio phonon calculation for Cd2GaAgS4 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Cd2GaAgS4
,
Phonon
, and
Pmn2_1 (31)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Si(Cu4S3)2 / Pmn2_1 (31) / materials id 13872
Description/Abstract:
Ab-initio phonon calculation for Si(Cu4S3)2 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Phonon
,
Pmn2_1 (31)
, and
Si(Cu4S3)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na3AsO4 / Pmn2_1 (31) / materials id 756044
Description/Abstract:
Ab-initio phonon calculation for Na3AsO4 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Na3AsO4
,
Phonon
, and
Pmn2_1 (31)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CdAg2GeS4 / Pmn2_1 (31) / materials id 554105
Description/Abstract:
Ab-initio phonon calculation for CdAg2GeS4 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
CdAg2GeS4
,
Phonon
, and
Pmn2_1 (31)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Pb2Se(NO4)2 / Pmn2_1 (31) / materials id 615850
Description/Abstract:
Ab-initio phonon calculation for Pb2Se(NO4)2 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
Pb2Se(NO4)2
,
Phonon
, and
Pmn2_1 (31)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K3SnIrCl8 / Pmn2_1 (31) / materials id 568970
Description/Abstract:
Ab-initio phonon calculation for K3SnIrCl8 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
K3SnIrCl8
,
Phonon
, and
Pmn2_1 (31)
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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Phonon
55
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Atsushi Togo
55
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55
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phonopy
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spglib
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