Research Article

A Theoretical Study on the Inclusion of Fe, Cu, and Zn in Illite Clays

Figure 3

Total DOS plot for (a) illite and the inclusion of (b) Fe3+, (c) Cu2+, and (d) Zn2+ in the (1, 0, 0) site. In the inset: PDOS of the O p-states from illite.
(a)
(b)
(c)
(d)