mp-1110848/K2AgSbF6/harm

Harmonic properties

../../_images/fig_bandos_pr16311.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20748.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16310.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215904.png

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

Summary

../../_images/fig_times26811.png

(a) Computation time