mp-1104271/Ag3SbS3/harm

Harmonic properties

../../_images/fig_bandos_pr16610.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20976.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16609.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc216182.png

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

Summary

../../_images/fig_times27165.png

(a) Computation time