mp-1222753/LaTiNO2/harm

Harmonic properties

../../_images/fig_bandos_pr15329.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos19702.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15328.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc214935.png

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

Summary

../../_images/fig_times25356.png

(a) Computation time