mp-1111329/Na2GaAgF6/harm

Harmonic properties

../../_images/fig_bandos_pr16356.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20789.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16355.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215946.png

(a) Force constants w.r.t atomic distance

Summary

../../_images/fig_times26856.png

(a) Computation time