mp-1192933/CsAlSiO4/harm

Harmonic properties

../../_images/fig_bandos_pr15818.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20209.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15817.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215413.png

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

Summary

../../_images/fig_times26060.png

(a) Computation time