Computational modelling of TiO2surfaces sensitized by organic dyes with different anchoring groups: adsorption modes, electronic structure and implication for electron injection/recombination

Electron Transfer Dynamics in Dye-Sensitized Solar Cells

(2011) Andrea Listorti et al.   CHEMISTRY OF MATERIALS

Phenoxazine Dyes for Dye-Sensitized Solar Cells: Relationship Between Molecular Structure and Electron Lifetime

(2011) Karl Martin Karlsson et al.   CHEMISTRY-A EUROPEAN JOURNAL

Organic dyes incorporating low-band-gap chromophores based on π-extended benzothiadiazole for dye-sensitized solar cells

(2011) Dong Hyun Lee et al.   DYES AND PIGMENTS

Energy levels, charge injection, charge recombination and dye regeneration dynamics for donor–acceptor π-conjugated organic dyes in mesoscopic TiO2 sensitized solar cells

(2011) Miquel Planells et al.   Energy & Environmental Science

Absorption Spectra and Excited State Energy Levels of the N719 Dye on TiO2 in Dye-Sensitized Solar Cell Models

(2011) Filippo De Angelis et al.   Journal of Physical Chemistry C

Probing Dye-Correlated Interplay of Energetics and Kinetics in Mesoscopic Titania Solar Cells with 4-tert-Butylpyridine

(2011) Huijin Long et al.   Journal of Physical Chemistry C

Computational Modeling of Stark Effects in Organic Dye-Sensitized TiO2 Heterointerfaces

(2011) Mariachiara Pastore et al.   Journal of Physical Chemistry Letters

Direct vs. indirect injection mechanisms in perylene dye-sensitized solar cells: A DFT/TDDFT investigation

(2010) Filippo De Angelis   CHEMICAL PHYSICS LETTERS

Dye-Sensitized Solar Cells

(2010) Anders Hagfeldt et al.   CHEMICAL REVIEWS

Interfacial Behavior of Benzoic Acid and Phenylphosphonic Acid on Nanocrystalline TiO2Surfaces

(2010) Erdene-Ochir Ganbold et al.   Chemistry-An Asian Journal

Injection Limitations in a Series of Porphyrin Dye-Sensitized Solar Cells

(2010) Tracy Dos Santos et al.   Journal of Physical Chemistry C

Electronic Structure of TiO2 Surfaces and Effect of Molecular Adsorbates Using Different DFT Implementations

(2010) Natalia Martsinovich et al.   Journal of Physical Chemistry C

A Computational Investigation of Organic Dyes for Dye-Sensitized Solar Cells: Benchmark, Strategies, and Open Issues

(2010) Mariachiara Pastore et al.   Journal of Physical Chemistry C

DFT Investigations of Formic Acid Adsorption on Single-Wall TiO2 Nanotubes: Effect of the Surface Curvature

(2010) Francesca Nunzi et al.   Journal of Physical Chemistry C

Ab Initio Determination of Ground and Excited State Oxidation Potentials of Organic Chromophores for Dye-Sensitized Solar Cells

(2010) Mariachiara Pastore et al.   Journal of Physical Chemistry C

Protonation-Dependent Binding of Ruthenium Bipyridyl Complexes to the Anatase(101) Surface

(2010) Florian Schiffmann et al.   Journal of Physical Chemistry C

First-Principles Modeling of the Adsorption Geometry and Electronic Structure of Ru(II) Dyes on Extended TiO2 Substrates for Dye-Sensitized Solar Cell Applications

(2010) Filippo De Angelis et al.   Journal of Physical Chemistry C

The Influence of Local Electric Fields on Photoinduced Absorption in Dye-Sensitized Solar Cells

(2010) Ute B. Cappel et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Further Understanding of the Adsorption Mechanism of N719 Sensitizer on Anatase TiO2Films for DSSC Applications Using Vibrational Spectroscopy and Confocal Raman Imaging

(2010) Kee Eun Lee et al.   LANGMUIR

Electronic and molecular structures of organic dye/TiO2 interfaces for solar cell applications: a core level photoelectron spectroscopy study

(2010) Maria Hahlin et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Aggregation of Organic Dyes on TiO2 in Dye-Sensitized Solar Cells Models: An ab Initio Investigation

(2009) Mariachiara Pastore et al.   ACS Nano

Time-dependent density functional theory study of squaraine dye-sensitized solar cells

(2009) Dario Rocca et al.   CHEMICAL PHYSICS LETTERS

Effect of Anchoring Group on Electron Injection and Recombination Dynamics in Organic Dye-Sensitized Solar Cells

(2009) Joanna Wiberg et al.   Journal of Physical Chemistry C

A Combined Experimental and Computational Investigation of Anthracene Based Sensitizers for DSSC: Comparison of Cyanoacrylic and Malonic Acid Electron Withdrawing Groups Binding onto the TiO2 Anatase (101) Surface

(2009) Kola Srinivas et al.   Journal of Physical Chemistry C

High Open-Circuit Voltage Solid-State Dye-Sensitized Solar Cells with Organic Dye

(2009) Peter Chen et al.   NANO LETTERS

Dynamics of the Photoexcited Electron at the Chromophore–Semiconductor Interface

(2008) Oleg V. Prezhdo et al.   ACCOUNTS OF CHEMICAL RESEARCH

Photodriven heterogeneous charge transfer with transition-metal compounds anchored to TiO2semiconductor surfaces

(2008) Shane Ardo et al.   CHEMICAL SOCIETY REVIEWS

Dynamical Simulation of Photoinduced Electron Transfer Reactions in Dye−Semiconductor Systems with Different Anchor Groups

(2008) Jingrui Li et al.   Journal of Physical Chemistry C

Effect of Different Dye Baths and Dye-Structures on the Performance of Dye-Sensitized Solar Cells Based on Triphenylamine Dyes

(2008) Haining Tian et al.   Journal of Physical Chemistry C

Molecular Engineering of Organic Sensitizers for Dye-Sensitized Solar Cell Applications

(2008) Daniel P. Hagberg et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Characterization of Solid-State Dye-Sensitized Solar Cells Utilizing High Absorption Coefficient Metal-Free Organic Dyes

(2008) Wendy H. Howie et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Rhodaninedyes for dye-sensitized solar cells :  spectroscopy, energy levels and photovoltaic performance

(2008) Tannia Marinado et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS