mp-1191962-2/CdIClO3/harm

Harmonic properties

../../_images/fig_bandos_pr15760.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20120.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15759.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215355.png

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

Summary

../../_images/fig_times25954.png

(a) Computation time