DFT calculations of IR and Raman spectra of Ru(bpy)2(CN)2 complex
Minaev B.F., Minaeva V.A., Minaeva V.A., Agren H., Girtu M., Bogdan Khmelnitskij national University, UA
In order to understand mechanism of electron transfer in dye-sensitized solar cell based on organic-inorganic junction we have studied the role of vibronic perturbations in metal-to-ligand and ligand-to-ligand charge transfer states excitations and in electron [...]