mp-1207215/Sr2NdNbO6/harm

Harmonic properties

../../_images/fig_bandos_pr15490.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19855.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15489.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215085.png

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

Summary

../../_images/fig_times25584.png

(a) Computation time