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Pna2_1 (33)
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Ab-initio phonon calculation for BaNaAlF6 / Pna2_1 (33) / materials id 15515
Description/Abstract:
Ab-initio phonon calculation for BaNaAlF6 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
BaNaAlF6
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for LiP5 / Pna2_1 (33) / materials id 2412
Description/Abstract:
Ab-initio phonon calculation for LiP5 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
LiP5
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for LiB6O9F / Pna2_1 (33) / materials id 558105
Description/Abstract:
Ab-initio phonon calculation for LiB6O9F / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
LiB6O9F
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for LiSiBiO4 / Pna2_1 (33) / materials id 757874
Description/Abstract:
Ab-initio phonon calculation for LiSiBiO4 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
LiSiBiO4
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for LiAgF2 / Pna2_1 (33) / materials id 752882
Description/Abstract:
Ab-initio phonon calculation for LiAgF2 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
LiAgF2
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for P4Se5 / Pna2_1 (33) / materials id 2447
Description/Abstract:
Ab-initio phonon calculation for P4Se5 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
P4Se5
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for RbScAsO4F / Pna2_1 (33) / materials id 15865
Description/Abstract:
Ab-initio phonon calculation for RbScAsO4F / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Phonon
,
Pna2_1 (33)
, and
RbScAsO4F
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Na2Ti2O5 / Pna2_1 (33) / materials id 779729
Description/Abstract:
Ab-initio phonon calculation for Na2Ti2O5 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Na2Ti2O5
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for NaCaPO4 / Pna2_1 (33) / materials id 14401
Description/Abstract:
Ab-initio phonon calculation for NaCaPO4 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
NaCaPO4
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Cd(BO2)2 / Pna2_1 (33) / materials id 780395
Description/Abstract:
Ab-initio phonon calculation for Cd(BO2)2 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Cd(BO2)2
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
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