cF360-Zr4H47.99936N12F28.0032 (Inverse)

cF360–Zr₄H_47.99936N₁₂F_28.0032 (Inverse)

Image of cF360–Zr₄H_47.99936N₁₂F_28.0032 (Inverse), generated by Vesta

Lattice Vectors:

\[\begin{split}a_1 &= 1/\sqrt{2}~\hat{y} + 1/\sqrt{2}~\hat{z}\\ a_2 &= 1/\sqrt{2}~\hat{x} + 1/\sqrt{2}~\hat{z}\\ a_3 &= 1/\sqrt{2}~\hat{x} + 1/\sqrt{2}~\hat{y}\\\end{split}\]

Space Group: 196

Point Group of Structure: \(23\)

Structure DOI: https://doi.org/10.1007/s10947-008-0066-8

Source: Inorganic Crystallographic Database #418095

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

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

Gap Atlas for \(\varepsilon = 14\)

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

Gap Atlas for \(\varepsilon = 12\)

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

Gap Atlas for \(\varepsilon = 10\)

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

Gap between Bands 10-11

Below is the band structure and isosurface of cF360–Zr₄H_47.99936N₁₂F_28.0032 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.18\) and filling fraction \(\phi = 0.147\).

Band Structure across first Brillouin Zone.

View along \(a_1\).

View along \(a_2\).