oP72-Cd4P2I3 (Direct)

oP72–Cd4P2I3 (Direct)

../_images/structure286.jpg

Image of oP72–Cd4P2I3 (Direct), generated by Vesta

Lattice Vectors:

\[\begin{split}a_1 &= ~\hat{x}\\ a_2 &= 0.9871993827~\hat{y}\\ a_3 &= 0.9816912293~\hat{z}\\\end{split}\]

Space Group: 61

Point Group of Structure: \(mmm\)

Structure DOI: https://doi.org/10.1107/S0567740880007157

Source: Crystallographic Open Database #1001135

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

../_images/gap_atlas-16282.png

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

Gap Atlas for \(\varepsilon = 14\)

../_images/gap_atlas-14282.png

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

Gap between Bands 16-17

Below is the band structure and isosurface of oP72–Cd4P2I3 (Direct) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.105\) and filling fraction \(\phi = 0.159\).

../_images/band_diagram_b=1652.jpg

Band Structure across first Brillouin Zone.

../_images/oP72-Cd4P2I3@gap_16-17.png

View along \(a_1\).