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1. Ab-initio phonon calculation for Sr5B3ClO9 / C222_1 (20) / materials id 555203

Description/Abstract:: Ab-initio phonon calculation for Sr5B3ClO9 / C222_1 (20) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:: C222_1 (20), Phonon, and Sr5B3ClO9
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 25/05/2023