mp-1194344/Nd4PClO8/harm

Harmonic properties

../../_images/fig_bandos_pr15868.png

(a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos20277.png

(b) Phonon dispersion and DOS

../../_images/fig_thermo15867.png

(c) Thermodynamic properties

Force constants

../../_images/fig_fc215463.png

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

Summary

../../_images/fig_times26150.png

(a) Computation time