Research Article

Synthesis, Characterization, and Photocatalysis of Fe-Doped : A Combined Experimental and Theoretical Study

Figure 6

The PDOS of pure TiO2 (a), 48 atom supercell containing one oxygen defect (b), 48 atom supercell containing a Fe ion (c), and 108 atom supercell containing two adjacent Fe ions and oxygen defect (d).
368750.fig.006a
(a)
368750.fig.006b
(b)
368750.fig.006c
(c)
368750.fig.006d
(d)