mp-555746-2/InAg3P2O8/harm

Equation of state

../../_images/fig_bm4375.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr8665.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos12175.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo8665.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc28426.png

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

Summary

../../_images/fig_times15187.png

(a) Computation time