mp-557319/InH8C4NO10/harm

Harmonic properties

../../_images/fig_bandos_pr8410.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos11818.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo8410.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc28172.png

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

Summary

../../_images/fig_times14766.png

(a) Computation time