cP86-Al12Si12Ag11.48O48 (Inverse)

cP86–Al12Si12Ag11.48O48 (Inverse)

../_images/structure318.jpg

Image of cP86–Al12Si12Ag11.48O48 (Inverse), generated by Vesta

Lattice Vectors:

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

Space Group: 221

Point Group of Structure: \(m\bar{3}m\)

Structure DOI: https://doi.org/10.1021/ja00490a035

Source: Crystallographic Open Database #4119064

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

../_images/gap_atlas-16314.png

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

Gap Atlas for \(\varepsilon = 14\)

../_images/gap_atlas-14314.png

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

Gap Atlas for \(\varepsilon = 12\)

../_images/gap_atlas-12265.png

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

Gap Atlas for \(\varepsilon = 10\)

../_images/gap_atlas-10205.png

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

Gap Atlas for \(\varepsilon = 8\)

../_images/gap_atlas-8134.png

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

Gap Atlas for \(\varepsilon = 6\)

../_images/gap_atlas-673.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 cP86–Al12Si12Ag11.48O48 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.2\) and filling fraction \(\phi = 0.27\).

../_images/band_diagram_b=521.jpg

Band Structure across first Brillouin Zone.

../_images/cP86-Ag1148Al12O48Si12_r@gap_5-6.png

View along \(a_1\).

../_images/cP86-Al12Si12Ag1148O48_r@gap_5-6.png

View along \(a_2\).

Gap between Bands 11-12

Below is the band structure and isosurface of cP86–Al12Si12Ag11.48O48 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.28\) and filling fraction \(\phi = 0.121\).

../_images/band_diagram_b=1110.jpg

Band Structure across first Brillouin Zone.

../_images/cP86-Ag1148Al12O48Si12_r@gap_11-12.png

View along \(a_1\).

../_images/cP86-Al12Si12Ag1148O48_r@gap_11-12.png

View along \(a_2\).

Gap between Bands 13-14

Below is the band structure and isosurface of cP86–Al12Si12Ag11.48O48 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.2\) and filling fraction \(\phi = 0.27\).

../_images/band_diagram_b=139.jpg

Band Structure across first Brillouin Zone.

../_images/cP86-Ag1148Al12O48Si12_r@gap_13-14.png

View along \(a_1\).

../_images/cP86-Al12Si12Ag1148O48_r@gap_13-14.png

View along \(a_2\).