Predicting light absorption properties of anthocyanidins in solution: a multi-level computational approach
Author:
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry
Link
http://link.springer.com/content/pdf/10.1007/s00214-016-1911-z.pdf
Reference69 articles.
1. O’Regan B, Grätzel M (1991) A low-cost, high-efficiency solar cell based on dye-sensitized colloidal TiO2 films. Nature 353:737
2. Monat JE, Rodriguez JH, McCusker JK (2002) Ground- and Excited-State Electronic Structures of the Solar Cell Sensitizer Bis(4,4′-dicarboxylato-2,2′-bipyridine)bis(isothiocyanato)ruthenium(II). J Phys Chem A 106:7399
3. De Angelis F, Fantacci S, Selloni A, Grätzel M, Nazeeruddin MK (2007) Influence of the sensitizer adsorption mode on the open-circuit potential of dye-sensitized solar cells. Nano Lett 7:3189–3195
4. Graetzel M (2009) Recent advances in sensitized mesoscopic solar cells. Acc Chem Res 42:1788–1798
5. De Angelis F, Fantacci S, Selloni A, Nazeeruddin MK, Grätzel M (2011) First-principles modeling of the adsorption geometry and electronic structure of Ru(II) Dyes on extended TiO2 substrates for dye-sensitized solar cell applications. J Phys Chem C 114:6054–6061
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