mp-570311-2/K4Sr2SnAs4/harm

Equation of state

../../_images/fig_bm3636.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr6795.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos9753.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo6795.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc26582.png

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

Summary

../../_images/fig_times12194.png

(a) Computation time