mp-1224876/GaAgSnSe4/harm

Harmonic properties

../../_images/fig_bandos_pr15067.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19426.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15066.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214683.png

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

Summary

../../_images/fig_times24934.png

(a) Computation time