mp-28361/Al2CdCl8/harm

Harmonic properties

../../_images/fig_bandos_pr11821.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos15835.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo11821.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc211532.png

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

Summary

../../_images/fig_times20057.png

(a) Computation time