mp-1044660/CaSn2P2O8/harm

Harmonic properties

../../_images/fig_bandos_pr17036.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos21372.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo17035.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc216588.png

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

Summary

../../_images/fig_times27771.png

(a) Computation time