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Ab-initio phonon calculation for CuCl / F-43m (216) / materials id 22914

Description/Abstract:

Ab-initio phonon calculation for CuCl / F-43m (216) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...

Keyword:

CuCl, F-43m (216), and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

26/05/2023
Ab-initio phonon calculation for CuCl / Pa-3 (205) / materials id 23287

Description/Abstract:

Ab-initio phonon calculation for CuCl / Pa-3 (205) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...

Keyword:

CuCl, Pa-3 (205), and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

15/05/2023