mp-1111272/Na2CuSbF6/harm

Harmonic properties

../../_images/fig_bandos_pr16344.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20777.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16343.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215934.png

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

Summary

../../_images/fig_times26844.png

(a) Computation time