mp-1224814/Ga2CuAgS4/harm

Harmonic properties

../../_images/fig_bandos_pr15057.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19416.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15056.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214673.png

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

Summary

../../_images/fig_times24923.png

(a) Computation time