mp-698349/CdH6C4S4O2/harm

Harmonic properties

../../_images/fig_bandos_pr4726.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos6572.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo4726.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc24537.png

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

Summary

../../_images/fig_times8387.png

(a) Computation time