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Ab-initio phonon calculation for Ca(SmS2)2 / I-42d (122) / materials id 36100
Description/Abstract:
Ab-initio phonon calculation for Ca(SmS2)2 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Ca(SmS2)2
,
I-42d (122)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for Ca(LaS2)2 / I-42d (122) / materials id 35421
Description/Abstract:
Ab-initio phonon calculation for Ca(LaS2)2 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Ca(LaS2)2
,
I-42d (122)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for B2PdO4 / I-42d (122) / materials id 540900
Description/Abstract:
Ab-initio phonon calculation for B2PdO4 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
B2PdO4
,
I-42d (122)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for Sm2PbSe4 / I-42d (122) / materials id 674804
Description/Abstract:
Ab-initio phonon calculation for Sm2PbSe4 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
I-42d (122)
,
Phonon
, and
Sm2PbSe4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for BeSiN2 / I-42d (122) / materials id 15704
Description/Abstract:
Ab-initio phonon calculation for BeSiN2 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
BeSiN2
,
I-42d (122)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for Sm2Te3 / I-42d (122) / materials id 684911
Description/Abstract:
Ab-initio phonon calculation for Sm2Te3 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
I-42d (122)
,
Phonon
, and
Sm2Te3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for PH6NO4 / I-42d (122) / materials id 23672
Description/Abstract:
Ab-initio phonon calculation for PH6NO4 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
I-42d (122)
,
PH6NO4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for Sr(NdS2)2 / I-42d (122) / materials id 37108
Description/Abstract:
Ab-initio phonon calculation for Sr(NdS2)2 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
I-42d (122)
,
Phonon
, and
Sr(NdS2)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for AlAgSe2 / I-42d (122) / materials id 14091
Description/Abstract:
Ab-initio phonon calculation for AlAgSe2 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
AlAgSe2
,
I-42d (122)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for CdSiP2 / I-42d (122) / materials id 4666
Description/Abstract:
Ab-initio phonon calculation for CdSiP2 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
CdSiP2
,
I-42d (122)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
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Dataset
115
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MDR phonon calculation database
115
Keyword
I-42d (122)
[remove]
115
Phonon
115
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NIMS
115
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115
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Creative Commons BY Attribution 4.0 International
115
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115
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Atsushi Togo
115
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MEXT
115
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VASP
115
phonopy
115
spglib
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