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Filtering by: Keyword KAg2PS4 Resource type Dataset

Ab-initio phonon calculation for KAg2PS4 / I-42m (121) / materials id 12532

Description/Abstract:

Ab-initio phonon calculation for KAg2PS4 / I-42m (121) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...

Keyword:

I-42m (121), KAg2PS4, and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

25/05/2023