oF12-TiSi2 (Inverse)

oF12–TiSi2 (Inverse)

../_images/structure315.jpg

Image of oF12–TiSi2 (Inverse), generated by Vesta

Lattice Vectors:

\[\begin{split}a_1 &= 0.4658307783~\hat{y} + 0.8848738249~\hat{z}\\ a_2 &= 0.4316172332~\hat{x} + 0.8848738249~\hat{z}\\ a_3 &= 0.4316172332~\hat{x} + 0.4658307783~\hat{y}\\\end{split}\]

Space Group: 69

Point Group of Structure: \(mmm\)

Structure DOI: https://doi.org/10.1557/PROC-481-605

Source: Crystallographic Open Database #1009012

MPB Epsilon Input File: Download

Gap Atlas for \(\varepsilon = 16\)

../_images/gap_atlas-16311.png

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

Gap Atlas for \(\varepsilon = 14\)

../_images/gap_atlas-14311.png

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

Gap Atlas for \(\varepsilon = 12\)

../_images/gap_atlas-12262.png

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

Gap between Bands 16-17

Below is the band structure and isosurface of oF12–TiSi2 (Inverse) at dielectric contrast \(\varepsilon = 16\), radius \(r = 0.29\) and filling fraction \(\phi = 0.172\).

../_images/band_diagram_b=1656.jpg

Band Structure across first Brillouin Zone.

../_images/oF12-TiSi2_r@gap_16-17.png

View along \(a_1\).