mp-761057/Sr5Nb4O15/harm

Harmonic properties

../../_images/fig_bandos_pr2940.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos3687.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo2940.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22760.png

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

Summary

../../_images/fig_times4976.png

(a) Computation time