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phonopy
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Ab-initio phonon calculation for CaTa2Bi2O9 / Cmc2_1 (36) / materials id 556697
Ab-initio phonon calculation for Li2CuSb / F-43m (216) / materials id 15988
Ab-initio phonon calculation for K3LiSi4 / Pnma (62) / materials id 28316
Ab-initio phonon calculation for Rb2Se5 / P2_12_12_1 (19) / materials id 620372
Ab-initio phonon calculation for NaTl2GaF6 / Fm-3m (225) / materials id 989561
Ab-initio phonon calculation for BeH8SO8 / I-4c2 (120) / materials id 23996
Ab-initio phonon calculation for SbIrS / P2_13 (198) / materials id 8630
Ab-initio phonon calculation for Na2PtSe2 / Cmc2_1 (36) / materials id 14588
Ab-initio phonon calculation for Er3SiCuS7 / P6_3 (173) / materials id 558980
Ab-initio phonon calculation for Ba7Pb17O24 / Pm (6) / materials id 758059
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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