mp-1095296/Dy4Te3S4/harm

Harmonic properties

../../_images/fig_bandos_pr16675.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos21035.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16674.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc216245.png

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

Summary

../../_images/fig_times27250.png

(a) Computation time