mp-697285/SrH10S2O8/harm

Harmonic properties

../../_images/fig_bandos_pr4684.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos6495.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo4684.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc24495.png

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

Summary

../../_images/fig_times8296.png

(a) Computation time