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Hg3(NO4)2
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Ab-initio phonon calculation for Hg3(NO4)2 / Pbca (61) / materials id 559722
Description/Abstract:
Ab-initio phonon calculation for Hg3(NO4)2 / Pbca (61) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Hg3(NO4)2
,
Pbca (61)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
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1
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MDR phonon calculation database
1
Keyword
Hg3(NO4)2
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1
Pbca (61)
1
Phonon
1
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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
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Atsushi Togo
1
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MEXT
1
Software
VASP
1
phonopy
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spglib
1