mp-18733/AlTlMo2O8/harm

Equation of state

../../_images/fig_bm6790.png

(a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr13596.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos17957.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo13596.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc213224.png

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

Summary

../../_images/fig_times22851.png

(a) Computation time