mp-1205960/K2SnF6/harm

Harmonic properties

../../_images/fig_bandos_pr15434.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19814.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15433.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215037.png

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

Summary

../../_images/fig_times25515.png

(a) Computation time