mp-16055/KLi3Zr2Si12O30/anharm

Space group: P6/mcc (192)
Link: Materials Project
Download: mp-16055.tar.gz

Equation of state

../../_images/fig_bm7190.png — (a) Equation of state

Harmonic properties

../../_images/fig_bandos_pr14377.png — (a) Phonon dispersion with participation ratio and DOS

../../_images/fig_bandos18752.png — (b) Phonon dispersion and DOS

../../_images/fig_thermo14377.png — (c) Thermodynamic properties

Thermal conductivity

Force constants

../../_images/fig_fc214002.png — (a) Force constants w.r.t atomic distance

Summary

../../_images/fig_times23974.png — (a) Computation time