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21.
Phono3py input data to calculate lattice thermal conductvities for zincblende-CdS
Description/Abstract:
Phono3py input data used to calculate the lattice thermal conductivities of zincblende-CdS in Fig.17 of the paper https://doi.org/10.7566...
Keyword:
Phonon
and
zincblende-CdS
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
22.
Phono3py input data to calculate lattice thermal conductvities for zincblende-InSb
Description/Abstract:
Phono3py input data used to calculate the lattice thermal conductivities of zincblende-InSb in Fig.17 of the paper https://doi.org/10.756...
Keyword:
Phonon
and
zincblende-InSb
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
23.
Phono3py input data to calculate lattice thermal conductvities for zincblende-GaSb
Description/Abstract:
Forces and parameters required for non-analytical term correction (Born effective charges and dielectric constants) were calculated using...
Keyword:
Phonon
and
zincblende-GaSb
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
24.
Phono3py input data to calculate lattice thermal conductvities for wurtzite-GaN
Description/Abstract:
Forces and parameters required for non-analytical term correction (Born effective charges and dielectric constants) were calculated using...
Keyword:
Phonon
and
wurtzite-GaN
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
25.
Phono3py input data to calculate lattice thermal conductvities for wurtzite-BN
Description/Abstract:
Phono3py input data used to calculate the lattice thermal conductivities of wurtzite-BN in Fig.17 of the paper https://doi.org/10.7566/JP...
Keyword:
Phonon
and
wurtzite-BN
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
26.
Phono3py input data to calculate lattice thermal conductvities for wurtzite-MgTe
Description/Abstract:
Phono3py input data used to calculate the lattice thermal conductivities of wurtzite-MgTe in Fig.17 of the paper https://doi.org/10.7566/...
Keyword:
Phonon
and
wurtzite-MgTe
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
27.
Phono3py input data to calculate lattice thermal conductvities for rocksalt-KF
Description/Abstract:
Forces and parameters required for non-analytical term correction (Born effective charges and dielectric constants) were calculated using...
Keyword:
Phonon
and
rocksalt-KF
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
28.
Phono3py input data to calculate lattice thermal conductvities for zincblende-MgTe
Description/Abstract:
Phono3py input data used to calculate the lattice thermal conductivities of zincblende-MgTe in Fig.17 of the paper https://doi.org/10.756...
Keyword:
Phonon
and
zincblende-MgTe
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
29.
Phono3py input data to calculate lattice thermal conductvities for rocksalt-RbCl
Description/Abstract:
Phono3py input data used to calculate the lattice thermal conductivities of rocksalt-RbCl in Fig.17 of the paper https://doi.org/10.7566/...
Keyword:
Phonon
and
rocksalt-RbCl
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
30.
Phono3py input data to calculate lattice thermal conductvities for zincblende-GaN
Description/Abstract:
Phono3py input data used to calculate the lattice thermal conductivities of zincblende-GaN in Fig.17 of the paper https://doi.org/10.7566...
Keyword:
Phonon
and
zincblende-GaN
Resource Type:
Dataset
Data origin:
simulations
Author:
Atsushi Togo
Date Uploaded:
28/01/2024
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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
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P2_1/c (14)
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10,137
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phonopy
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spglib
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