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5031.
Ab-initio phonon calculation for Cs3InO3 / P2_1/c (14) / materials id 28381
Description/Abstract:
Ab-initio phonon calculation for Cs3InO3 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Cs3InO3
,
P2_1/c (14)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5032.
Ab-initio phonon calculation for KZnP / P6_3/mmc (194) / materials id 7437
Description/Abstract:
Ab-initio phonon calculation for KZnP / P6_3/mmc (194) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
KZnP
,
P6_3/mmc (194)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5033.
Ab-initio phonon calculation for Sr5Ta4O15 / P-3c1 (165) / materials id 769582
Description/Abstract:
Ab-initio phonon calculation for Sr5Ta4O15 / P-3c1 (165) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
P-3c1 (165)
,
Phonon
, and
Sr5Ta4O15
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5034.
Ab-initio phonon calculation for Ba4LaGe3SbSe13 / P2_1/c (14) / materials id 683936
Description/Abstract:
Ab-initio phonon calculation for Ba4LaGe3SbSe13 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, a...
Keyword:
Ba4LaGe3SbSe13
,
P2_1/c (14)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5035.
Ab-initio phonon calculation for CdI2 / P3m1 (156) / materials id 570552
Description/Abstract:
Ab-initio phonon calculation for CdI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
P3m1 (156)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5036.
Ab-initio phonon calculation for SmSnF7 / P2_1/c (14) / materials id 17418
Description/Abstract:
Ab-initio phonon calculation for SmSnF7 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
P2_1/c (14)
,
Phonon
, and
SmSnF7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5037.
Ab-initio phonon calculation for ErClO / Pmmn (59) / materials id 755689
Description/Abstract:
Ab-initio phonon calculation for ErClO / Pmmn (59) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
ErClO
,
Phonon
, and
Pmmn (59)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5038.
Ab-initio phonon calculation for Y2SiO5 / P2_1/c (14) / materials id 554420
Description/Abstract:
Ab-initio phonon calculation for Y2SiO5 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
P2_1/c (14)
,
Phonon
, and
Y2SiO5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5039.
Ab-initio phonon calculation for SrLiNb2O6F / I-4m2 (119) / materials id 753719
Description/Abstract:
Ab-initio phonon calculation for SrLiNb2O6F / I-4m2 (119) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
I-4m2 (119)
,
Phonon
, and
SrLiNb2O6F
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
5040.
Ab-initio phonon calculation for Ba2TiO4 / P2_1/c (14) / materials id 3397
Description/Abstract:
Ab-initio phonon calculation for Ba2TiO4 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ba2TiO4
,
P2_1/c (14)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
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Lattice thermal conductivity calculation datasets for 103 binary compounds by finite displacement method
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