mp-1191663/Te8RuCl2/harm

Harmonic properties

../../_images/fig_bandos_pr15744.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20103.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15743.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215339.png

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

Summary

../../_images/fig_times25930.png

(a) Computation time