Real-time TD-DFT simulations in dye sensitized solar cells: The electronic absorption spectrum of alizarin supported on TiO2 nanoclusters

  1. Sánchez-De-Armas, R.
  2. Oviedo López, J.
  3. San-Miguel, M.A.
  4. Sanz, J.F.
  5. Ordejón, P.
  6. Pruneda, M.
Journal:
Journal of Chemical Theory and Computation

ISSN: 1549-9626,  1549-9618

Year of publication: 2010

Volume: 6

Issue: 9

Pages: 2856-2865

Type: Article

DOI: 10.1021/CT100289T GOOGLE SCHOLAR
Data source: Scopus