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Ab-initio phonon calculation for CsSnBr3 / Pm-3m (221) / materials id 27214
Ab-initio phonon calculation for Rb4Br2O / I4/mmm (139) / materials id 30004
Ab-initio phonon calculation for Ga2O3 / C2/m (12) / materials id 886
Ab-initio phonon calculation for Rb3Sm(PS4)2 / P2_1 (4) / materials id 17894
Ab-initio phonon calculation for Na2ZnSiO4 / Pc (7) / materials id 6391
Ab-initio phonon calculation for ZnSeO3 / Pbca (61) / materials id 5338
Ab-initio phonon calculation for BaAgTeF / P4/nmm (129) / materials id 16742
Ab-initio phonon calculation for CaIn2O4 / Fd-3m (227) / materials id 22766
Ab-initio phonon calculation for In(HO)3 / R-3 (148) / materials id 626412
Ab-initio phonon calculation for Cs2TeCl6 / Fm-3m (225) / materials id 23465
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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
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
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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
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10,137
spglib
10,137
phono3py
103