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ZnH3CNO3
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Ab-initio phonon calculation for ZnH3CNO3 / Pna2_1 (33) / materials id 604229
Description/Abstract:
Ab-initio phonon calculation for ZnH3CNO3 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Phonon
,
Pna2_1 (33)
, and
ZnH3CNO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
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Dataset
1
Collection
MDR phonon calculation database
1
Keyword
Phonon
1
Pna2_1 (33)
1
ZnH3CNO3
[remove]
1
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NIMS
1
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Dataset
1
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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
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MEXT
1
Software
VASP
1
phonopy
1
spglib
1