oP6-As2(Co,Ni,Fe) (Direct)

oP6–As2(Co,Ni,Fe) (Direct)

../_images/structure24.jpg

Image of oP6–As2(Co,Ni,Fe) (Direct), generated by Vesta

Lattice Vectors:

\[\begin{split}a_1 &= ~\hat{x}\\ a_2 &= 1.1592690197~\hat{y}\\ a_3 &= 0.6186425748~\hat{z}\\\end{split}\]

Space Group: 58

Point Group of Structure: \(mmm\)

Structure DOI: https://doi.org/10.1107/S1600536808026688

Source: Crystallographic Open Database #2219402

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

../_images/gap_atlas-1624.png

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

Gap Atlas for \(\varepsilon = 14\)

../_images/gap_atlas-1424.png

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

Gap Atlas for \(\varepsilon = 12\)

../_images/gap_atlas-1217.png

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

Gap between Bands 8-9

Below is the band structure and isosurface of oP6–As2(Co,Ni,Fe) (Direct) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.25\) and filling fraction \(\phi = 0.54\).

../_images/band_diagram_b=82.jpg

Band Structure across first Brillouin Zone.

../_images/oP6-As2(Co,Ni,Fe)@gap_8-9.png

View along \(a_1\).

../_images/oP6-oP6-As2(Co,Ni,Fe)@gap_8-9.png

View along \(a_2\).