mp-1401938/SnF4/harm

Harmonic properties

../../_images/fig_bandos_pr14569.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos18927.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo14569.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214188.png

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

Summary

../../_images/fig_times24238.png

(a) Computation time