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Ab-initio phonon calculation for Na3NbOF6 / P2_12_12_1 (19) / materials id 561259

Description/Abstract:

Ab-initio phonon calculation for Na3NbOF6 / P2_12_12_1 (19) Phonon band structure, phonon DOS, thermal properties at constant volume, and...

Keyword:

Na3NbOF6, P2_12_12_1 (19), and Phonon

Resource Type:

Dataset

Data origin:

simulation

Author:

Atsushi Togo

Date Uploaded:

25/05/2023