Computational Prediction of Electronic and Photovoltaic Properties of Anthracene-Based Organic Dyes for Dye-Sensitized Solar Cells

Table 9

Reorganization energy of MS3, TY3, and TY6 in gas and solvent phases.

		MS3	TY3	TY6
Gas		0.18	0.21	0.20
		0.27	0.33	0.33
		0.45	0.54	0.53
Solvent		0.17	0.19	0.17
		0.23	0.25	0.25
		0.40	0.44	0.42