tP10-Pd4S (Inverse)

tP10–Pd4S (Inverse)

../_images/structure340.jpg

Image of tP10–Pd4S (Inverse), generated by Vesta

Lattice Vectors:

\[\begin{split}a_1 &= ~\hat{x}\\ a_2 &= ~\hat{y}\\ a_3 &= 1.0929869313022103~\hat{z}\\\end{split}\]

Space Group: 114

Point Group of Structure: \(\bar{42}m\)

Structure DOI: https://doi.org/10.3891/acta.chem.scand.10-1440

Source: Inorganic Crystallographic Database #648748

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

../_images/gap_atlas-16335.png

Gap Atlas for \(\varepsilon\) = 16 across filling fraction \(\phi\) and frequency \(\omega\).

Gap Atlas for \(\varepsilon = 14\)

../_images/gap_atlas-14336.png

Gap Atlas for \(\varepsilon\) = 14 across filling fraction \(\phi\) and frequency \(\omega\).

Gap between Bands 18-19

Below is the band structure and isosurface of tP10–Pd4S (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.285\) and filling fraction \(\phi = 0.176\).

../_images/band_diagram_b=1829.jpg

Band Structure across first Brillouin Zone.

../_images/tP10-Pd4S_r@gap_18-19.png

View along \(a_1\).