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Ab-initio phonon calculation for SbSI / Pnma (62) / materials id 23041
Description/Abstract:
Ab-initio phonon calculation for SbSI / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Phonon
,
Pnma (62)
, and
SbSI
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CsReO4 / Pnma (62) / materials id 17621
Description/Abstract:
Ab-initio phonon calculation for CsReO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CsReO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for TmBiO3 / R3c (161) / materials id 754323
Description/Abstract:
Ab-initio phonon calculation for TmBiO3 / R3c (161) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R3c (161)
, and
TmBiO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Ag2PdCl4 / Cmce (64) / materials id 28557
Description/Abstract:
Ab-initio phonon calculation for Ag2PdCl4 / Cmce (64) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Ag2PdCl4
,
Cmce (64)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for K2ReI6 / P2_1/c (14) / materials id 30216
Description/Abstract:
Ab-initio phonon calculation for K2ReI6 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
K2ReI6
,
P2_1/c (14)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbEr2Cu3Se5 / Cmcm (63) / materials id 16884
Description/Abstract:
Ab-initio phonon calculation for RbEr2Cu3Se5 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Cmcm (63)
,
Phonon
, and
RbEr2Cu3Se5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Rb2ZrO3 / Cmc2_1 (36) / materials id 756156
Description/Abstract:
Ab-initio phonon calculation for Rb2ZrO3 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Cmc2_1 (36)
,
Phonon
, and
Rb2ZrO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Rb3Sb5O14 / Pbam (55) / materials id 556234
Description/Abstract:
Ab-initio phonon calculation for Rb3Sb5O14 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Pbam (55)
,
Phonon
, and
Rb3Sb5O14
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for LiCuCO3 / Ibca (73) / materials id 752638
Description/Abstract:
Ab-initio phonon calculation for LiCuCO3 / Ibca (73) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ibca (73)
,
LiCuCO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Ba4LiNb3O12 / Pnma (62) / materials id 774715
Description/Abstract:
Ab-initio phonon calculation for Ba4LiNb3O12 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Ba4LiNb3O12
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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10,034
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9
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MDR phonon calculation database
10,034
The history of DICE and NIMS Digital Library
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10,034
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10,034
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10,043
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10,040
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10,034
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Atsushi Togo
10,034
Hiori Kino
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Takashi Miyake
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10,043
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VASP
10,034
phonopy
10,034
spglib
10,034
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PHYSICAL REVIEW B
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Physical Review Applied
1
SOLID STATE IONICS
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Science and Technology of Advanced Materials: Methods
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