mp-1227677/BaSrBiSbO6/harm

Harmonic properties

../../_images/fig_bandos_pr15129.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19505.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15128.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214744.png

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

Summary

../../_images/fig_times25039.png

(a) Computation time