Insight into Perovskite Solar Cell Formation for Various Organohalides Perovskite Precursors in the Presence of Water at the Molecular Level

Table 1

Simulation details for the various organohalides perovskite precursors in the water.

	Designed systems	Pb	Cl	Organohalides	Water
1	Reference	20	40	−	−
2	Iso-BA^+	20	60	20	−
3		20	60	20	500
4	PEA^+	20	60	20	−
5		20	60	20	500
6	EDBE^2+	20	80	20	−
7		20	80	20	500
8	GA^+	20	60	20	−
9		20	60	20	500