mp-866617/Cs2Sr2C3O9/harm

Harmonic properties

../../_images/fig_bandos_pr1618.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos1546.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo1618.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc21451.png

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

Summary

../../_images/fig_times2428.png

(a) Computation time