mp-726394-2/SrCl2O2/harm

Harmonic properties

../../_images/fig_bandos_pr4206.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos5779.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo4206.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc24019.png

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

Summary

../../_images/fig_times7408.png

(a) Computation time