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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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Collection
Lattice thermal conductivity calculation datasets for 103 binary compounds by finite displacement method
103
Keyword
Phonon
103
rocksalt-AgBr
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rocksalt-AgCl
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rocksalt-BaO
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rocksalt-BaS
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NIMS
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Dataset
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open
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Creative Commons BY Attribution 4.0 International
103
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simulations
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Author
Atsushi Togo
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Software
VASP
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phono3py
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phonopy
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spglib
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