mp-13276-2/SrLiP/harm

Harmonic properties

../../_images/fig_bandos_pr14858.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19237.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo14858.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214476.png

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

Summary

../../_images/fig_times24659.png

(a) Computation time