mp-11919-2/SrBe2N2/harm

Harmonic properties

../../_images/fig_bandos_pr16489.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20883.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo16488.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc216064.png

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

Summary

../../_images/fig_times26993.png

(a) Computation time