mp-638236/OsC4Cl2O4/harm

Harmonic properties

../../_images/fig_bandos_pr5687.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos8191.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo5687.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc25485.png

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

Summary

../../_images/fig_times10293.png

(a) Computation time