mp-1110569/Na3InF6/harm

Harmonic properties

../../_images/fig_bandos_pr16276.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20714.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16275.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215869.png

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

Summary

../../_images/fig_times26776.png

(a) Computation time