mp-849327-2/Li2CuP3O9/harm

Equation of state

../../_images/fig_bm647.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr1698.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos1660.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo1698.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc21531.png

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

Summary

../../_images/fig_times2562.png

(a) Computation time