mp-1189171/Zn2NCl/harm

Harmonic properties

../../_images/fig_bandos_pr15906.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20317.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15905.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215501.png

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

Summary

../../_images/fig_times26203.png

(a) Computation time