mp-554781-2/Tb3CuSnS7/harm

Harmonic properties

../../_images/fig_bandos_pr9082.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos12805.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo9082.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc28844.png

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

Summary

../../_images/fig_times15894.png

(a) Computation time