Oxygen Dependence of Formation, Electronic State Transition, and Spin Polarization for Anatase TiO₂: A Comprehensive Study

Table 1

Coordinates of high symmetry points within the first Brillouin zone for anatase TiO₂.

G	F	Q	Z
0, 0, 0	0, 0.5, 0	0, 0.5, 0.5	0, 0, 0.5