mp-759099/Li3SbP2O8/harm

Equation of state

../../_images/fig_bm1323.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr3032.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos3888.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3032.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22852.png

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

Summary

../../_images/fig_times5190.png

(a) Computation time