cP8-NbCu3S4 (Inverse)

cP8–NbCu3S4 (Inverse)

../_images/structure141.jpg

Image of cP8–NbCu3S4 (Inverse), generated by Vesta

Lattice Vectors:

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

Space Group: 215

Point Group of Structure: \(\bar{43}m\)

Structure DOI: https://doi.org/10.1107/S1600536805022397

Source: Crystallographic Open Database #2206580

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

../_images/gap_atlas-16139.png

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

Gap Atlas for \(\varepsilon = 14\)

../_images/gap_atlas-14139.png

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

Gap Atlas for \(\varepsilon = 12\)

../_images/gap_atlas-12113.png

Gap Atlas for \(\varepsilon\) = 12 across filling fraction \(\phi\) and frequency \(\omega\).

Gap Atlas for \(\varepsilon = 10\)

../_images/gap_atlas-1087.png

Gap Atlas for \(\varepsilon\) = 10 across filling fraction \(\phi\) and frequency \(\omega\).

Gap Atlas for \(\varepsilon = 8\)

../_images/gap_atlas-849.png

Gap Atlas for \(\varepsilon\) = 8 across filling fraction \(\phi\) and frequency \(\omega\).

Gap Atlas for \(\varepsilon = 6\)

../_images/gap_atlas-628.png

Gap Atlas for \(\varepsilon\) = 6 across filling fraction \(\phi\) and frequency \(\omega\).

Gap between Bands 5-6

Below is the band structure and isosurface of cP8–NbCu3S4 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.315\) and filling fraction \(\phi = 0.261\).

../_images/band_diagram_b=511.jpg

Band Structure across first Brillouin Zone.

../_images/cP8-NbCu3S4_r@gap_5-6.png

View along \(a_1\).

Gap between Bands 8-9

Below is the band structure and isosurface of cP8–NbCu3S4 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.33\) and filling fraction \(\phi = 0.211\).

../_images/band_diagram_b=827.jpg

Band Structure across first Brillouin Zone.

../_images/cP8-NbCu3S4_r@gap_8-9.png

View along \(a_1\).

Gap between Bands 11-12

Below is the band structure and isosurface of cP8–NbCu3S4 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.37\) and filling fraction \(\phi = 0.087\).

../_images/band_diagram_b=112.jpg

Band Structure across first Brillouin Zone.

../_images/cP8-NbCu3S4_r@gap_11-12.png

View along \(a_1\).

Gap between Bands 16-17

Below is the band structure and isosurface of cP8–NbCu3S4 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.35\) and filling fraction \(\phi = 0.147\).

../_images/band_diagram_b=1625.jpg

Band Structure across first Brillouin Zone.

../_images/cP8-NbCu3S4_r@gap_16-17.png

View along \(a_1\).

Gap between Bands 19-20

Below is the band structure and isosurface of cP8–NbCu3S4 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.345\) and filling fraction \(\phi = 0.162\).

../_images/band_diagram_b=193.jpg

Band Structure across first Brillouin Zone.

../_images/cP8-NbCu3S4_r@gap_19-20.png

View along \(a_1\).