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LiAgF2
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Ab-initio phonon calculation for LiAgF2 / C2 (5) / materials id 752767
Description/Abstract:
Ab-initio phonon calculation for LiAgF2 / C2 (5) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
C2 (5)
,
LiAgF2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiAgF2 / Pmn2_1 (31) / materials id 753277
Description/Abstract:
Ab-initio phonon calculation for LiAgF2 / Pmn2_1 (31) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
LiAgF2
,
Phonon
, and
Pmn2_1 (31)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiAgF2 / P6_3/mmc (194) / materials id 752927
Description/Abstract:
Ab-initio phonon calculation for LiAgF2 / P6_3/mmc (194) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
LiAgF2
,
P6_3/mmc (194)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for LiAgF2 / Cmcm (63) / materials id 758302
Description/Abstract:
Ab-initio phonon calculation for LiAgF2 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Cmcm (63)
,
LiAgF2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for LiAgF2 / C2/m (12) / materials id 752549
Description/Abstract:
Ab-initio phonon calculation for LiAgF2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
LiAgF2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
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 LiAgF2 / I-42d (122) / materials id 758604
Description/Abstract:
Ab-initio phonon calculation for LiAgF2 / I-42d (122) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
I-42d (122)
,
LiAgF2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
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7
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MDR phonon calculation database
7
Keyword
LiAgF2
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7
Phonon
7
C2 (5)
1
C2/m (12)
1
Cmcm (63)
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NIMS
7
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Creative Commons BY Attribution 4.0 International
7
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simulation
7
Author
Atsushi Togo
7
Funder
MEXT
7
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VASP
7
phonopy
7
spglib
7