cP46-NaAlSiClO (Direct)

cP46–NaAlSiClO (Direct)

../_images/structure26.jpg

Image of cP46–NaAlSiClO (Direct), generated by Vesta

Lattice Vectors:

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

Space Group: 218

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

Structure DOI: https://doi.org/10.1107/s0108768184001683

Source: Crystallographic Open Database #1000028

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

../_images/gap_atlas-1626.png

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

Gap Atlas for \(\varepsilon = 14\)

../_images/gap_atlas-1426.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 cP46–NaAlSiClO (Direct) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.115\) and filling fraction \(\phi = 0.279\).

../_images/band_diagram_b=186.jpg

Band Structure across first Brillouin Zone.

../_images/cP46-NaAlSiClO@gap_18-19.png

View along \(a_1\).