cP20-CsCd(NO2)3 (Direct)

cP20–CsCd(NO2)3 (Direct)

../_images/structure276.jpg

Image of cP20–CsCd(NO2)3 (Direct), generated by Vesta

Lattice Vectors:

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

Space Group: 200

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

Structure DOI: https://doi.org/10.1016/0022-5088(79)90251-0

Source: Crystallographic Open Database #1529593

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

../_images/gap_atlas-16272.png

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

Gap Atlas for \(\varepsilon = 14\)

../_images/gap_atlas-14272.png

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

Gap Atlas for \(\varepsilon = 12\)

../_images/gap_atlas-12230.png

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

Gap Atlas for \(\varepsilon = 10\)

../_images/gap_atlas-10174.png

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

Gap between Bands 17-18

Below is the band structure and isosurface of cP20–CsCd(NO2)3 (Direct) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.21\) and filling fraction \(\phi = 0.417\).

../_images/band_diagram_b=1711.jpg

Band Structure across first Brillouin Zone.

../_images/cP20-CsCd(NO2)3@gap_17-18.png

View along \(a_1\).