mp-34656/CdC2N2/harm

Harmonic properties

../../_images/fig_bandos_pr10488.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_thermo10488.png

(b) Thermodynamic properties

Force constants

../../_images/fig_fc210230.png

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

Summary

../../_images/fig_times18063.png

(a) Computation time