mp-5974/La2Si2O7/harm

Harmonic properties

../../_images/fig_bandos_pr9783.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos13652.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo9783.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc29539.png

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

Summary

../../_images/fig_times16999.png

(a) Computation time