mp-17743/Sr3Sn2O7/harm

Harmonic properties

../../_images/fig_bandos_pr14002.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos18384.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo14002.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc213630.png

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

Summary

../../_images/fig_times23437.png

(a) Computation time