Research Article

Hybrid Perovskite, CH3NH3PbI3, for Solar Applications: An Experimental and Theoretical Analysis of Substitution in A and B Sites

Table 3

Geometrical parameters, identified in Figure 4, of the structures studied.

Structure

MAPbI3158.35157.11155.03156.52
(A)0.25(MA)0.75PbI3158.17157.06154.36156.73
(A)0.50(MA)0.50PbI3156.37155.54153.73156.45
(A)0.75(MA)0.25PbI3146.35142.08148.84148.04
APbI3146.22142.80147.57147.46