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Filtering by: Keyword PbI2 Remove constraint Keyword: PbI2 Collection MDR phonon calculation database Remove constraint Collection: MDR phonon calculation database

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Ab-initio phonon calculation for PbI2 / R-3m (166) / materials id 640058

Description/Abstract:

Ab-initio phonon calculation for PbI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

PbI2, Phonon, and R-3m (166)

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for PbI2 / P6_3mc (186) / materials id 567542

Description/Abstract:

Ab-initio phonon calculation for PbI2 / P6_3mc (186) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...

Keyword:

P6_3mc (186), PbI2, and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for PbI2 / R-3m (166) / materials id 540789

Description/Abstract:

Ab-initio phonon calculation for PbI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

PbI2, Phonon, and R-3m (166)

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for PbI2 / P3m1 (156) / materials id 580202

Description/Abstract:

Ab-initio phonon calculation for PbI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

P3m1 (156), PbI2, and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

25/05/2023
Ab-initio phonon calculation for PbI2 / P3m1 (156) / materials id 567199

Description/Abstract:

Ab-initio phonon calculation for PbI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

P3m1 (156), PbI2, and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

23/05/2023
Ab-initio phonon calculation for PbI2 / P-3m1 (164) / materials id 22893

Description/Abstract:

Ab-initio phonon calculation for PbI2 / P-3m1 (164) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...

Keyword:

P-3m1 (164), PbI2, and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

23/05/2023
Ab-initio phonon calculation for PbI2 / R-3m (166) / materials id 569595

Description/Abstract:

Ab-initio phonon calculation for PbI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

PbI2, Phonon, and R-3m (166)

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

18/05/2023
Ab-initio phonon calculation for PbI2 / P6_3mc (186) / materials id 567503

Description/Abstract:

Ab-initio phonon calculation for PbI2 / P6_3mc (186) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...

Keyword:

P6_3mc (186), PbI2, and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

17/05/2023
Ab-initio phonon calculation for PbI2 / P3m1 (156) / materials id 567246

Description/Abstract:

Ab-initio phonon calculation for PbI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

P3m1 (156), PbI2, and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

16/05/2023
Ab-initio phonon calculation for PbI2 / P3m1 (156) / materials id 680205

Description/Abstract:

Ab-initio phonon calculation for PbI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

P3m1 (156), PbI2, and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

15/05/2023

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Type of work

Dataset11

Collection

MDR phonon calculation database[remove]11

Keyword

PbI2[remove]11
Phonon11
P3m1 (156)5
R-3m (166)3
P6_3mc (186)2
more Keywords »

Publisher

NIMS11

Resource type

Dataset11

Visibility

open11

Rights Statement Sim

Creative Commons BY Attribution 4.0 International11

Data origin

simulation11

Author

Atsushi Togo11

Funder

MEXT11

Software

VASP11
phonopy11
spglib11

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