mp-10013-2/SnS/harm

Equation of state

../../_images/fig_bm154.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr489.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos437.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo489.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc2415.png

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

Summary

../../_images/fig_times742.png

(a) Computation time