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Atsushi Togo
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NIMS
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Phono3py input data to calculate lattice thermal conductvities for wurtzite-CuBr
Phono3py input data to calculate lattice thermal conductvities for rocksalt-CaS
Phono3py input data to calculate lattice thermal conductvities for wurtzite-ZnS
Phono3py input data to calculate lattice thermal conductvities for zincblende-AlN
Phono3py input data to calculate lattice thermal conductvities for zincblende-CuCl
Phono3py input data to calculate lattice thermal conductvities for zincblende-AgI
Phono3py input data to calculate lattice thermal conductvities for rocksalt-LiBr
Phono3py input data to calculate lattice thermal conductvities for wurtzite-CdS
Phono3py input data to calculate lattice thermal conductvities for rocksalt-LiI
Phono3py input data to calculate lattice thermal conductvities for rocksalt-PbS
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Dataset
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10,137
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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)
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Pnma (62)
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C2/c (15)
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C2/m (12)
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Creative Commons BY Attribution 4.0 International
10,137
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simulation
10,034
simulations
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Author
Atsushi Togo
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10,137
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MEXT
10,034
Software
VASP
10,137
phonopy
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spglib
10,137
phono3py
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