mp-555186/Li2ZnSnS4/harm

Equation of state

../../_images/fig_bm4476.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr8865.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos12498.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo8865.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc28626.png

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

Summary

../../_images/fig_times15550.png

(a) Computation time