mp-560761/RbGa3P6O20/harm

Harmonic properties

../../_images/fig_bandos_pr7562.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos10636.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo7562.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc27326.png

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

Summary

../../_images/fig_times13387.png

(a) Computation time