| Belt-shaped π-systems: relating geometry to electronic structure in a six-porphyrin nanoring JK Sprafke, DV Kondratuk, M Wykes, AL Thompson, M Hoffmann, ... Journal of the American Chemical Society 133 (43), 17262-17273, 2011 | 215 | 2011 |
| Positioning of antioxidant quercetin and its metabolites in lipid bilayer membranes: implication for their lipid-peroxidation inhibition P Kosinova, K Berka, M Wykes, M Otyepka, P Trouillas The Journal of Physical Chemistry B 116 (4), 1309-1318, 2012 | 162 | 2012 |
| Ground-and excited-state pinched cone equilibria in calix [4] arenes bearing two perylene bisimide dyes C Hippius, IHM van Stokkum, E Zangrando, RM Williams, M Wykes, ... The Journal of Physical Chemistry C 112 (37), 14626-14638, 2008 | 97 | 2008 |
| Computational engineering of low bandgap copolymers M Wykes, B Milián-Medina, J Gierschner Frontiers in Chemistry 1, 35, 2013 | 79 | 2013 |
| Excited state features and dynamics in a distyrylbenzene-based mixed stack donor–acceptor cocrystal with luminescent charge transfer characteristics M Wykes, SK Park, S Bhattacharyya, S Varghese, JE Kwon, DR Whang, ... The Journal of Physical Chemistry Letters 6 (18), 3682-3687, 2015 | 52 | 2015 |
| Vibronic coupling in molecular crystals: A Franck-Condon Herzberg-Teller model of H-aggregate fluorescence based on quantum chemical cluster calculations M Wykes, R Parambil, D Beljonne, J Gierschner The Journal of Chemical Physics 143 (11), 2015 | 48 | 2015 |
| A Conjugated Thiophene‐Based Rotaxane: Synthesis, Spectroscopy, and Modeling L Zalewski, M Wykes, S Brovelli, M Bonini, T Breiner, M Kastler, F Dötz, ... Chemistry–A European Journal 16 (13), 3933-3941, 2010 | 35 | 2010 |
| Self‐Assembled Conjugated Thiophene‐Based Rotaxane Architectures: Structural, Computational, and Spectroscopic Insights into Molecular Aggregation L Zalewski, S Brovelli, M Bonini, JM Mativetsky, M Wykes, E Orgiu, ... Advanced Functional Materials 21 (5), 834-844, 2011 | 31 | 2011 |
| Low-temperature photoluminescence spectroscopy of solvent-free PCBM single-crystals G Tregnago, M Wykes, GM Paternò, D Beljonne, F Cacialli The Journal of Physical Chemistry C 119 (21), 11846-11851, 2015 | 29 | 2015 |
| Double hybrid functionals and the Π-system bond length alternation challenge: rivaling accuracy of post-HF methods M Wykes, NQ Su, X Xu, C Adamo, JC Sancho-Garcia Journal of Chemical Theory and Computation 11 (2), 832-838, 2015 | 26 | 2015 |
| Synthesis and photophysics of coaxial threaded molecular wires: polyrotaxanes with triarylamine jackets G Sforazzini, A Kahnt, M Wykes, JK Sprafke, S Brovelli, D Montarnal, ... The Journal of Physical Chemistry C 118 (8), 4553-4566, 2014 | 23 | 2014 |
| Dynamics of guest molecules in PHTP inclusion compounds as probed by solid-state NMR and fluorescence spectroscopy G Srinivasan, JA Villanueva-Garibay, K Müller, D Oelkrug, BM Medina, ... Physical Chemistry Chemical Physics 11 (25), 4996-5009, 2009 | 23 | 2009 |
| Effects of the environment on charge transport in molecular wires AA Kocherzhenko, KB Whaley, G Sforazzini, HL Anderson, M Wykes, ... The Journal of Physical Chemistry C 116 (48), 25213-25225, 2012 | 22 | 2012 |
| Self-assembled monolayers of protonated poly (amidoamine) dendrimers on indium tin oxide G Latini, M Wykes, R Schlapak, S Howorka, F Cacialli Applied Physics Letters 92 (1), 2008 | 20 | 2008 |
| Anchoring groups for dyes in p-DSSC application: insights from DFT M Wykes, F Odobel, C Adamo, I Ciofini, F Labat Journal of molecular modeling 22, 1-10, 2016 | 19 | 2016 |
| The diene isomerization energies dataset: A difficult test for double-hybrid density functionals? M Wykes, AJ Pérez-Jiménez, C Adamo, JC Sancho-Garcia The Journal of Chemical Physics 142 (22), 2015 | 17 | 2015 |
| Perylene Bisimide Cyclophanes: Structure–Property Relationships upon Variation of the Cavity Size J Rühe, D Bialas, P Spenst, AM Krause, F Würthner Organic Materials 2 (02), 149-158, 2020 | 12 | 2020 |
| Regio (ir) regular naphthalenediimide-and perylenediimide-bithiophene copolymers: how MO localization controls the bandgap B Milián-Medina, M Wykes, Z Chen, A Facchetti, J Gierschner Journal of Materials Chemistry C 4 (40), 9405-9410, 2016 | 12 | 2016 |
| Increased luminescence efficiency by synergistic exploitation of lipo/hydrophilic co-solvency and supramolecular design G Tregnago, M Serri, S Brovelli, SO McDonnell, P Korniychuk, L Wang, ... Journal of Materials Chemistry C 4 (46), 10893-10902, 2016 | 2 | 2016 |
| Bond length alternation of conjugated oligomers: Performance of recent double-hybrid functionals M Wykes, N Su, X Xu, C Adamo, J Sancho-Garcia ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 249, 2015 | | 2015 |
