mp-1080719/Sr2YTaO6/harm

Harmonic properties

../../_images/fig_bandos_pr16997.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos21306.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16996.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc216549.png

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

Summary

../../_images/fig_times27697.png

(a) Computation time