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Filtering by: Funder MEXT Remove constraint Funder: MEXT Keyword P3m1 (156) Remove constraint Keyword: P3m1 (156) Collection MDR phonon calculation database Remove constraint Collection: MDR phonon calculation database

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Ab-initio phonon calculation for CdI2 / P3m1 (156) / materials id 571667

Description/Abstract:

Ab-initio phonon calculation for CdI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

CdI2, P3m1 (156), and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

27/05/2023
Ab-initio phonon calculation for ZnS / P3m1 (156) / materials id 556784

Description/Abstract:

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

Keyword:

P3m1 (156), Phonon, and ZnS

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for ZnS / P3m1 (156) / materials id 647075

Description/Abstract:

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

Keyword:

P3m1 (156), Phonon, and ZnS

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for CdI2 / P3m1 (156) / materials id 570448

Description/Abstract:

Ab-initio phonon calculation for CdI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

CdI2, P3m1 (156), and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for CdI2 / P3m1 (156) / materials id 669326

Description/Abstract:

Ab-initio phonon calculation for CdI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

CdI2, P3m1 (156), and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for ZnS / P3m1 (156) / materials id 581425

Description/Abstract:

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

Keyword:

P3m1 (156), Phonon, and ZnS

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for SiC / P3m1 (156) / materials id 571298

Description/Abstract:

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

Keyword:

P3m1 (156), Phonon, and SiC

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for CdI2 / P3m1 (156) / materials id 680115

Description/Abstract:

Ab-initio phonon calculation for CdI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

CdI2, P3m1 (156), and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for ScCuS2 / P3m1 (156) / materials id 6980

Description/Abstract:

Ab-initio phonon calculation for ScCuS2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...

Keyword:

P3m1 (156), Phonon, and ScCuS2

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for CdI2 / P3m1 (156) / materials id 571654

Description/Abstract:

Ab-initio phonon calculation for CdI2 / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

CdI2, P3m1 (156), and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023

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Type of work

Dataset171

Collection

MDR phonon calculation database[remove]171

Keyword

P3m1 (156)[remove]171
Phonon171
CdI295
ZnS45
SiC8
more Keywords »

Publisher

NIMS171

Resource type

Dataset171

Visibility

open171

Rights Statement Sim

Creative Commons BY Attribution 4.0 International171

Data origin

simulation171

Author

Atsushi Togo171

Funder

MEXT[remove]171

Software

VASP171
phonopy171
spglib171

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