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Phonon
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Ab-initio phonon calculation for Yb11GaSb9 / Iba2 (45) / materials id 569811
Ab-initio phonon calculation for Li2ZnCl4 / Fd-3m (227) / materials id 22961
Ab-initio phonon calculation for Dy(HO)3 / P6_3/m (176) / materials id 24074
Ab-initio phonon calculation for Ba3Lu2Zn5O11 / F-43m (216) / materials id 554066
Ab-initio phonon calculation for KY2CuS4 / Cmcm (63) / materials id 11602
Ab-initio phonon calculation for KAuO2 / Pmmm (47) / materials id 27418
Ab-initio phonon calculation for CsBi3Se5 / Pnma (62) / materials id 567928
Ab-initio phonon calculation for Ba2CuIO2 / P2_1/m (11) / materials id 561179
Ab-initio phonon calculation for SrPSe3 / P2_1/c (14) / materials id 7198
Ab-initio phonon calculation for Li4Ti7O16 / Pnnm (58) / materials id 531820
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Type of work
Dataset
10,137
Collection
MDR phonon calculation database
10,034
Lattice thermal conductivity calculation datasets for 103 binary compounds by finite displacement method
103
Keyword
Phonon
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10,137
P2_1/c (14)
1,072
Pnma (62)
839
C2/c (15)
599
C2/m (12)
368
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NIMS
10,137
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Dataset
10,137
Visibility
open
10,137
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
10,137
Data origin
simulation
10,034
simulations
103
Author
Atsushi Togo
10,137
Funder
MEXT
10,034
Software
VASP
10,137
phonopy
10,137
spglib
10,137
phono3py
103