Index Catalog // MDR

Start Over

Filtering by: Software spglib Keyword Ba2Cu2O5 Collection MDR phonon calculation database

Ab-initio phonon calculation for Ba2Cu2O5 / Pna2_1 (33) / materials id 772788

Description/Abstract:

Ab-initio phonon calculation for Ba2Cu2O5 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...

Keyword:

Ba2Cu2O5, Phonon, and Pna2_1 (33)

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

15/05/2023