mp-6110/Sr2YSbO6/harm

Harmonic properties

../../_images/fig_bandos_pr6637.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos9532.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo6637.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc26427.png

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

Summary

../../_images/fig_times11902.png

(a) Computation time