mp-555612/Sb4IrC5ClO5F22/harm

Harmonic properties

../../_images/fig_bandos_pr8647.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos12148.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo8647.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc28408.png

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

Summary

../../_images/fig_times15157.png

(a) Computation time