| A qualitative index of spatial extent in charge-transfer excitations T Le Bahers, C Adamo, I Ciofini Journal of chemical theory and computation 7 (8), 2498-2506, 2011 | 1171 | 2011 |
| What is the “best” atomic charge model to describe through-space charge-transfer excitations? D Jacquemin, T Le Bahers, C Adamo, I Ciofini Physical Chemistry Chemical Physics 14 (16), 5383-5388, 2012 | 346 | 2012 |
| Semiconductors used in photovoltaic and photocatalytic devices: assessing fundamental properties from DFT T Le Bahers, M Rerat, P Sautet The Journal of Physical Chemistry C 118 (12), 5997-6008, 2014 | 337 | 2014 |
| Through-space charge transfer in rod-like molecules: lessons from theory I Ciofini, T Le Bahers, C Adamo, F Odobel, D Jacquemin The Journal of Physical Chemistry C 116 (22), 11946-11955, 2012 | 271 | 2012 |
| First-principles modeling of dye-sensitized solar cells: challenges and perspectives F Labat, T Le Bahers, I Ciofini, C Adamo Accounts of chemical research 45 (8), 1268-1277, 2012 | 248 | 2012 |
| A TD-DFT investigation of ground and excited state properties in indoline dyes used for dye-sensitized solar cells T Le Bahers, T Pauporté, G Scalmani, C Adamo, I Ciofini Physical chemistry chemical physics 11 (47), 11276-11284, 2009 | 222 | 2009 |
| Wavelength‐emission tuning of ZnO nanowire‐based light‐emitting diodes by Cu doping: experimental and computational insights O Lupan, T Pauporté, T Le Bahers, B Viana, I Ciofini Advanced Functional Materials 21 (18), 3564-3572, 2011 | 199 | 2011 |
| Dendritic tip-on polytriazine-based carbon nitride photocatalyst with high hydrogen evolution activity MK Bhunia, S Melissen, MR Parida, P Sarawade, JM Basset, DH Anjum, ... Chemistry of Materials 27 (24), 8237-8247, 2015 | 172 | 2015 |
| Exploring excited states using time dependent density functional theory and density-based indexes C Adamo, T Le Bahers, M Savarese, L Wilbraham, G García, R Fukuda, ... Coordination Chemistry Reviews 304, 166-178, 2015 | 155 | 2015 |
| Modeling dye-sensitized solar cells: From theory to experiment T Le Bahers, T Pauporté, PP Lainé, F Labat, C Adamo, I Ciofini The Journal of Physical Chemistry Letters 4 (6), 1044-1050, 2013 | 134 | 2013 |
| Relationship between carbon nitride structure and exciton binding energies: a DFT perspective S Melissen, T Le Bahers, SN Steinmann, P Sautet The Journal of Physical Chemistry C 119 (45), 25188-25196, 2015 | 128 | 2015 |
| Theoretical procedure for optimizing dye-sensitized solar cells: from electronic structure to photovoltaic efficiency T Le Bahers, F Labat, T Pauporté, PP Lainé, I Ciofini Journal of the American Chemical Society 133 (20), 8005-8013, 2011 | 106 | 2011 |
| Electrodeposited nanoporous versus nanoparticulate ZnO films of similar roughness for dye-sensitized solar cell applications VM Guerin, C Magne, T Pauporté, T Le Bahers, J Rathousky ACS Applied Materials & Interfaces 2 (12), 3677-3685, 2010 | 104 | 2010 |
| Catalytic consequences of ultrafine Pt clusters supported on SrTiO3 for photocatalytic overall water splitting M Qureshi, AT Garcia-Esparza, G Jeantelot, S Ould-Chikh, ... Journal of Catalysis 376, 180-190, 2019 | 99 | 2019 |
| High Aspect Ratio Ternary Zn1–xCdxO Nanowires by Electrodeposition for Light-Emitting Diode Applications O Lupan, T Pauporté, T Le Bahers, I Ciofini, B Viana The Journal of Physical Chemistry C 115 (30), 14548-14558, 2011 | 93 | 2011 |
| Effect of solvent and additives on the open-circuit voltage of ZnO-based dye-sensitized solar cells: a combined theoretical and experimental study T Le Bahers, F Labat, T Pauporté, I Ciofini Physical Chemistry Chemical Physics 12 (44), 14710-14719, 2010 | 84 | 2010 |
| Dissolution on Titan and on Earth: Toward the age of Titan's karstic landscapes T Cornet, D Cordier, TL Bahers, O Bourgeois, C Fleurant, SL Mouélic, ... Journal of Geophysical Research: Planets 120 (6), 1044-1074, 2015 | 80 | 2015 |
| On the understanding of the optoelectronic properties of S-doped MoO 3 and O-doped MoS 2 bulk systems: a DFT perspective M Shahrokhi, P Raybaud, T Le Bahers Journal of Materials Chemistry C 8 (26), 9064-9074, 2020 | 74 | 2020 |
| Electronic properties of PbX 3 CH 3 NH 3 (X= Cl, Br, I) compounds for photovoltaic and photocatalytic applications STAG Melissen, F Labat, P Sautet, T Le Bahers Physical Chemistry Chemical Physics 17 (3), 2199-2209, 2015 | 74 | 2015 |
| The nature of vertical excited states of dyes containing metals for DSSC applications: insights from TD-DFT and density based indexes T Le Bahers, E Brémond, I Ciofini, C Adamo Physical Chemistry Chemical Physics 16 (28), 14435-14444, 2014 | 72 | 2014 |
Philippe SautetProfessor, University of California, Los AngelesVerified email at ucla.edu
