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Ab-initio phonon calculation for KSc2F7 / Cmmm (65) / materials id 28439
Description/Abstract:
Ab-initio phonon calculation for KSc2F7 / Cmmm (65) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Cmmm (65)
,
KSc2F7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
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Type of work
Dataset
1
Collection
MDR phonon calculation database
1
Keyword
Cmmm (65)
1
KSc2F7
[remove]
1
Phonon
1
Publisher
NIMS
1
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Dataset
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open
1
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
1
Data origin
simulation
1
Author
Atsushi Togo
1
Funder
MEXT
1
Software
VASP
1
phonopy
1
spglib
1