Spatial resolution of tip-enhanced Raman spectroscopy–DFT assessment of the chemical effect F Latorre, S Kupfer, T Bocklitz, D Kinzel, S Trautmann, S Gräfe, V Deckert Nanoscale 8 (19), 10229-10239, 2016 | 90 | 2016 |
4-Methoxy-1, 3-thiazole based donor-acceptor dyes: characterization, X-ray structure, DFT calculations and test as sensitizers for DSSC R Menzel, D Ogermann, S Kupfer, D Weiß, H Görls, K Kleinermanns, ... Dyes and Pigments 94 (3), 512-524, 2012 | 74 | 2012 |
A SERS-based molecular sensor for selective detection and quantification of copper (II) ions V Dugandžić, S Kupfer, M Jahn, T Henkel, K Weber, D Cialla-May, J Popp Sensors and Actuators B: Chemical 279, 230-237, 2019 | 64 | 2019 |
Dramatic Alteration of 3ILCT Lifetimes Using Ancillary Ligands in [Re(L)(CO)3(phen-TPA)]n+ Complexes: An Integrated Spectroscopic and Theoretical Study GE Shillito, TBJ Hall, D Preston, P Traber, L Wu, KEA Reynolds, ... Journal of the American Chemical Society 140 (13), 4534-4542, 2018 | 62 | 2018 |
[FeFe]-Hydrogenase H-cluster mimics mediated by naphthalene monoimide derivatives of peri-substituted dichalcogenides H Abul-Futouh, Y Zagranyarski, C Müller, M Schulz, S Kupfer, H Görls, ... Dalton Transactions 46 (34), 11180-11191, 2017 | 62 | 2017 |
Self-healing mechanism of metallopolymers investigated by QM/MM simulations and Raman spectroscopy S Kupfer, L Zedler, J Guthmuller, S Bode, MD Hager, US Schubert, J Popp, ... Physical Chemistry Chemical Physics 16 (24), 12422-12432, 2014 | 62 | 2014 |
Protonation effects on the resonance Raman properties of a novel (terpyridine) Ru (4 H-imidazole) complex: an experimental and theoretical case study S Kupfer, J Guthmuller, M Wächtler, S Losse, S Rau, B Dietzek, J Popp, ... Physical Chemistry Chemical Physics 13 (34), 15580-15588, 2011 | 60 | 2011 |
Cu (i) vs. Ru (ii) photosensitizers: elucidation of electron transfer processes within a series of structurally related complexes containing an extended π-system Y Zhang, P Traber, L Zedler, S Kupfer, S Gräfe, M Schulz, W Frey, ... Physical Chemistry Chemical Physics 20 (38), 24843-24857, 2018 | 58 | 2018 |
Resonance-Raman spectro-electrochemistry of intermediates in molecular artificial photosynthesis of bimetallic complexes L Zedler, J Guthmuller, IR de Moraes, S Kupfer, S Krieck, M Schmitt, ... Chemical Communications 50 (40), 5227-5229, 2014 | 58 | 2014 |
An artificial photosynthetic system for photoaccumulation of two electrons on a fused dipyridophenazine (dppz)–pyridoquinolinone ligand JF Lefebvre, J Schindler, P Traber, Y Zhang, S Kupfer, S Gräfe, ... Chemical Science 9 (17), 4152-4159, 2018 | 51 | 2018 |
The Self‐Healing Potential of Triazole‐Pyridine‐Based Metallopolymers B Sandmann, B Happ, S Kupfer, FH Schacher, MD Hager, US Schubert Macromolecular rapid communications 36 (7), 604-609, 2015 | 46 | 2015 |
Structural Control of Photoinduced Dynamics in 4H-Imidazole-Ruthenium Dyes M Wächtler, S Kupfer, J Guthmuller, S Rau, L Gonzalez, B Dietzek The Journal of Physical Chemistry C 116 (49), 25664-25676, 2012 | 46 | 2012 |
Sterically induced distortions of nickel (II) porphyrins–Comprehensive investigation by DFT calculations and resonance Raman spectroscopy J Schindler, S Kupfer, AA Ryan, KJ Flanagan, MO Senge, B Dietzek Coordination Chemistry Reviews 360, 1-16, 2018 | 43 | 2018 |
Photophysics of Ru(II) Dyads Derived from Pyrenyl-Substitued Imidazo[4,5-f][1,10]phenanthroline Ligands C Reichardt, M Pinto, M Wächtler, M Stephenson, S Kupfer, T Sainuddin, ... The Journal of Physical Chemistry A 119 (17), 3986-3994, 2015 | 43 | 2015 |
Trapped in Imidazole: How to Accumulate Multiple Photoelectrons on a Black‐Absorbing Ruthenium Complex L Zedler, S Kupfer, IR de Moraes, M Wächtler, R Beckert, M Schmitt, ... Chemistry–A European Journal 20 (13), 3793-3799, 2014 | 43 | 2014 |
Photochemistry and electron transfer kinetics in a photocatalyst model assessed by Marcus theory and quantum dynamics A Koch, D Kinzel, F Dröge, S Gräfe, S Kupfer The Journal of Physical Chemistry C 121 (30), 16066-16078, 2017 | 42 | 2017 |
An assessment of RASSCF and TDDFT energies and gradients on an organic donor–acceptor dye assisted by resonance raman spectroscopy S Kupfer, J Guthmuller, L Gonzalez Journal of Chemical Theory and Computation 9 (1), 543-554, 2013 | 42 | 2013 |
Active repair of a dinuclear photocatalyst for visible-light-driven hydrogen production MG Pfeffer, C Müller, ETE Kastl, AK Mengele, B Bagemihl, SS Fauth, ... Nature Chemistry 14 (5), 500-506, 2022 | 40 | 2022 |
pysisyphus: Exploring potential energy surfaces in ground and excited states J Steinmetzer, S Kupfer, S Gräfe International Journal of Quantum Chemistry 121 (3), e26390, 2021 | 40 | 2021 |
The chemical effect goes resonant–a full quantum mechanical approach on TERS K Fiederling, M Abasifard, M Richter, V Deckert, S Gräfe, S Kupfer Nanoscale 12 (11), 6346-6359, 2020 | 39 | 2020 |