mp-505233/Cs2SnH12N6/harm

Harmonic properties

../../_images/fig_bandos_pr9860.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos13767.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo9860.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc29615.png

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

Summary

../../_images/fig_times17135.png

(a) Computation time