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Correction to Molecules 2015, 20(8), 13830-13853.
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Correction

Correction: Gomez, T., et al. Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2. Molecules 2015, 20, 13830–13853

by
Tatiana Gomez
1,*,
Gunter Hermann
2,
Ximena Zarate
1,
Jhon Fredy Pérez-Torres
2 and
Jean Christophe Tremblay
2,*
1
Dirección de Postgrado e Investigación, Universidad Autónoma de Chile, Llano Subercaceaux 2801, San Miguel, Santiago, Chile
2
Institut für Chemie und Biochemie, Freie Universität Berlin, Takustraße 3, 14195 Berlin, Germany
*
Authors to whom correspondence should be addressed.
Molecules 2015, 20(10), 19027-19029; https://doi.org/10.3390/molecules201019027
Submission received: 10 October 2015 / Accepted: 12 October 2015 / Published: 20 October 2015
Versions Notes

The author wishes to make the following correction to this paper [1]. Due to mislabeling, please replace:
Table
Table 1. Calculated (Calc.) and experimental (Exp. [14]) excitation energies in eV, active molecular orbitals (MO) and their contributions in %. Top panel: time-dependent density functional theory (TDDFT)/Becke three-parameter-Lee-Parr-Yang (B3LYP); bottom panel: TDDFT/Perdew-Burke-Ernzerhof (PBE).
Table 1. Calculated (Calc.) and experimental (Exp. [14]) excitation energies in eV, active molecular orbitals (MO) and their contributions in %. Top panel: time-dependent density functional theory (TDDFT)/Becke three-parameter-Lee-Parr-Yang (B3LYP); bottom panel: TDDFT/Perdew-Burke-Ernzerhof (PBE).
AlizarinAlizarin-(TiO2)15
Calc.Exp. [14]MO (%)Calc.Exp.MO (%)
2.822.88HOMO→LUMO (97.7)2.66
3.35		2.47
3.54		HOMO→LUMO+2 (95.5)
HOMO-1→LUMO+1 (35.3)
HOMO-1→LUMO+2 (25.8)
HOMO-1→LUMO+5 (6.9)
HOMO→LUMO+4 (11.7)
3.743.54HOMO-4→LUMO+2 (43.9)
HOMO-4→LUMO+1 (9.4)
eHOMO-4→LUMO+5 (9.5)
HOMO→LUMO+20 (7.8)
HOMO→LUMO+22 (9.7)
2.29
3.28		2.88
3.82		HOMO→LUMO (95.1)
HOMO-4→LUMO (58.3)
HOMO→LUMO+1 (35.0)		2.162.47HOMO→LUMO+2 (25.6)
HOMO→LUMO+4 (11.3)
HOMO→LUMO+11 (17.6)
HOMO→LUMO+12 (24.0)
2.913.54HOMO-5→LUMO+3 (18.9)
HOMO-6→LUMO+2 (7.2)
HOMO-4→LUMO+2 (10.7)
HOMO-6→LUMO+4 (6.5)
HOMO-4→LUMO+7 (11.7)
HOMO→LUMO+26 (17.7)
With this corrected table:
Table
Table 1. Calculated (Calc.) and experimental (Exp. [14]) excitation energies in eV, active molecular orbitals (MO) and their contributions in %. Top panel: time-dependent density functional theory (TDDFT)/Becke three-parameter-Lee-Parr-Yang (B3LYP); bottom panel: TDDFT/Perdew-Burke-Ernzerhof (PBE).
Table 1. Calculated (Calc.) and experimental (Exp. [14]) excitation energies in eV, active molecular orbitals (MO) and their contributions in %. Top panel: time-dependent density functional theory (TDDFT)/Becke three-parameter-Lee-Parr-Yang (B3LYP); bottom panel: TDDFT/Perdew-Burke-Ernzerhof (PBE).
AlizarinAlizarin-(TiO2)15
Calc.Exp. [14]MO (%)Calc.Exp.MO (%)
2.822.88HOMO→LUMO (97.7)2.662.47HOMO→LUMO+2 (95.5)
3.353.54HOMO-1→LUMO+1 (35.3)
HOMO-1→LUMO+2 (25.8)
HOMO-1→LUMO+5 (6.9)
HOMO→LUMO+4 (11.7)
3.743.54HOMO-4→LUMO+2 (43.9)
HOMO-4→LUMO+1 (9.4)
HOMO-4→LUMO+5 (9.5)
HOMO→LUMO+20 (7.8)
HOMO→LUMO+22 (9.7)
2.292.88HOMO→LUMO (95.1)2.162.47HOMO→LUMO+2 (25.6)
3.283.82HOMO-4→LUMO (58.3) HOMO→LUMO+4 (11.3)
HOMO→LUMO+1 (35.0) HOMO→LUMO+11 (17.6)
HOMO→LUMO+12 (24.0)
2.913.54HOMO-5→LUMO+3 (18.9)
HOMO-6→LUMO+2 (7.2)
HOMO-4→LUMO+2 (10.7)
HOMO-6→LUMO+4 (6.5)
HOMO-4→LUMO+7 (11.7)
HOMO→LUMO+26 (17.7)
The authors would like to apologize for any inconvenience caused to the readers by these changes. We will update the paper [1] and the original will remain available on the article webpage.

References

  1. Gomez, T.; Hermann, G.; Zarate, X.; Pérez-Torres, J.F.; Tremblay, J.C. Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2. Molecules 2015, 20, 13830–13853. [Google Scholar] [CrossRef] [PubMed]

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MDPI and ACS Style

Gomez, T.; Hermann, G.; Zarate, X.; Pérez-Torres, J.F.; Tremblay, J.C. Correction: Gomez, T., et al. Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2. Molecules 2015, 20, 13830–13853. Molecules 2015, 20, 19027-19029. https://doi.org/10.3390/molecules201019027

AMA Style

Gomez T, Hermann G, Zarate X, Pérez-Torres JF, Tremblay JC. Correction: Gomez, T., et al. Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2. Molecules 2015, 20, 13830–13853. Molecules. 2015; 20(10):19027-19029. https://doi.org/10.3390/molecules201019027

Chicago/Turabian Style

Gomez, Tatiana, Gunter Hermann, Ximena Zarate, Jhon Fredy Pérez-Torres, and Jean Christophe Tremblay. 2015. "Correction: Gomez, T., et al. Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2. Molecules 2015, 20, 13830–13853" Molecules 20, no. 10: 19027-19029. https://doi.org/10.3390/molecules201019027

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