mp-769268/Sr4Ta2O9/harm

Harmonic properties

../../_images/fig_bandos_pr2659.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_thermo2659.png

(b) Thermodynamic properties

Force constants

../../_images/fig_fc22480.png

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

Summary

../../_images/fig_times4433.png

(a) Computation time