mp-6217/LaSc3B4O12/harm

Harmonic properties

../../_images/fig_bandos_pr6313.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos9174.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo6313.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc26103.png

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

Summary

../../_images/fig_times11433.png

(a) Computation time