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Ab-initio phonon calculation for AlH3 / R-3c (167) / materials id 23933
Description/Abstract:
Ab-initio phonon calculation for AlH3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
AlH3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
17/05/2023
Ab-initio phonon calculation for TeO3 / R-3c (167) / materials id 2552
Description/Abstract:
Ab-initio phonon calculation for TeO3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
R-3c (167)
, and
TeO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Hg3(BO3)2 / R-3c (167) / materials id 4710
Description/Abstract:
Ab-initio phonon calculation for Hg3(BO3)2 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Hg3(BO3)2
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Al2O3 / R-3c (167) / materials id 1143
Description/Abstract:
Ab-initio phonon calculation for Al2O3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Al2O3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for KRb3CdCl6 / R-3c (167) / materials id 570158
Description/Abstract:
Ab-initio phonon calculation for KRb3CdCl6 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
KRb3CdCl6
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Na2Sb4O11 / R-3c (167) / materials id 780683
Description/Abstract:
Ab-initio phonon calculation for Na2Sb4O11 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Na2Sb4O11
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Rb3Sc(HO)6 / R-3c (167) / materials id 541483
Description/Abstract:
Ab-initio phonon calculation for Rb3Sc(HO)6 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Phonon
,
R-3c (167)
, and
Rb3Sc(HO)6
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for NaZr2(PO4)3 / R-3c (167) / materials id 6475
Description/Abstract:
Ab-initio phonon calculation for NaZr2(PO4)3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
NaZr2(PO4)3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for K3AuSe2 / R-3c (167) / materials id 15571
Description/Abstract:
Ab-initio phonon calculation for K3AuSe2 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
K3AuSe2
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for LaGaO3 / R-3c (167) / materials id 3336
Description/Abstract:
Ab-initio phonon calculation for LaGaO3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
LaGaO3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Ba3(CrS3)2 / R-3c (167) / materials id 30904
Description/Abstract:
Ab-initio phonon calculation for Ba3(CrS3)2 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Ba3(CrS3)2
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Ba3Zr6BeCl18 / R-3c (167) / materials id 569563
Description/Abstract:
Ab-initio phonon calculation for Ba3Zr6BeCl18 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
Ba3Zr6BeCl18
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for LuBO3 / R-3c (167) / materials id 7560
Description/Abstract:
Ab-initio phonon calculation for LuBO3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
LuBO3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for NaHf2(PO4)3 / R-3c (167) / materials id 40161
Description/Abstract:
Ab-initio phonon calculation for NaHf2(PO4)3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
NaHf2(PO4)3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for CsZr2(PO4)3 / R-3c (167) / materials id 560091
Description/Abstract:
Ab-initio phonon calculation for CsZr2(PO4)3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
CsZr2(PO4)3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Ca3(BO3)2 / R-3c (167) / materials id 3575
Description/Abstract:
Ab-initio phonon calculation for Ca3(BO3)2 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ca3(BO3)2
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for NaCa3RuO6 / R-3c (167) / materials id 6281
Description/Abstract:
Ab-initio phonon calculation for NaCa3RuO6 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
NaCa3RuO6
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for Na4Hf2(GeO4)3 / R-3c (167) / materials id 14526
Description/Abstract:
Ab-initio phonon calculation for Na4Hf2(GeO4)3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
Na4Hf2(GeO4)3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for Rb6Cl4O / R-3c (167) / materials id 29468
Description/Abstract:
Ab-initio phonon calculation for Rb6Cl4O / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
R-3c (167)
, and
Rb6Cl4O
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for LiNbO3 / R-3c (167) / materials id 552588
Description/Abstract:
Ab-initio phonon calculation for LiNbO3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
LiNbO3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
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