mp-23150/CS2NClO2/harm

Equation of state

../../_images/fig_bm6451.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr12916.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos17302.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo12916.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc212612.png

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

Summary

../../_images/fig_times21857.png

(a) Computation time