mp-574684/Na2SnAs2/harm

Harmonic properties

../../_images/fig_bandos_pr6742.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos9688.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo6742.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc26531.png

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

Summary

../../_images/fig_times12106.png

(a) Computation time