mp-759472/LiCuH4O4/harm

Harmonic properties

../../_images/fig_bandos_pr3061.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos3955.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo3061.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc22881.png

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

Summary

../../_images/fig_times5260.png

(a) Computation time