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Eclipsed and Twisted Excimers of Pyrene and 2-Azapyrene: How Nitrogen Substitution Impacts Excimer Emission.
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- Molecules, 2024, v. 29, n. 2, p. 507, doi. 10.3390/molecules29020507
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- Article
77 % Photothermal Conversion in Blatter‐Type Diradicals: Photophysics and Photodynamic Applications.
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- Angewandte Chemie, 2023, v. 135, n. 42, p. 1, doi. 10.1002/ange.202311387
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- Article
77 % Photothermal Conversion in Blatter‐Type Diradicals: Photophysics and Photodynamic Applications.
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- Angewandte Chemie International Edition, 2023, v. 62, n. 42, p. 1, doi. 10.1002/anie.202311387
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- Article
Ambipolar Charge Transport in Organic Semiconductors: How Intramolecular Reorganization Energy Is Controlled by Diradical Character.
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- Molecules, 2023, v. 28, n. 12, p. 4642, doi. 10.3390/molecules28124642
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- Article
Orbital Nature of Carboionic Monoradicals Made from Diradicals.
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- Chemistry - A European Journal, 2023, v. 29, n. 27, p. 1, doi. 10.1002/chem.202300388
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- Article
Impact of Di- and Poly-Radical Characters on the Relative Energy of the Doubly Excited and L a States of Linear Acenes and Cyclacenes.
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- Chemistry (2624-8549), 2023, v. 5, n. 1, p. 616, doi. 10.3390/chemistry5010044
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- Article
Meso‐2‐MethoxyNaphthalenyl‐BODIPY as Efficient Organic Dye for Metallaphotoredox Catalysis.
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- ChemCatChem, 2023, v. 15, n. 3, p. 1, doi. 10.1002/cctc.202201380
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- Article
Tuning the Electro‐Optical Properties of Mixed‐Halide Trityl Radicals Bearing para‐Brominated Positions through Halogen Substitution.
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- European Journal of Organic Chemistry, 2023, v. 26, n. 1, p. 1, doi. 10.1002/ejoc.202201030
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- Article
Beyond the 2D Field‐Effect Charge Transport Paradigm in Molecular Thin‐Film Transistors.
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- Advanced Electronic Materials, 2023, v. 9, n. 1, p. 1, doi. 10.1002/aelm.202200547
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- Article
Intermolecular Interactions and Charge Resonance Contributions to Triplet and Singlet Exciton States of Oligoacene Aggregates.
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- Molecules, 2023, v. 28, n. 1, p. 119, doi. 10.3390/molecules28010119
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- Article
UPS, XPS, NEXAFS and Computational Investigation of Acrylamide Monomer.
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- Photochem, 2022, v. 2, n. 3, p. 463, doi. 10.3390/photochem2030032
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- Article
Medium Diradical Character, Small Hole and Electron Reorganization Energies and Ambipolar Transistors in Difluorenoheteroles.
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- Angewandte Chemie, 2022, v. 134, n. 33, p. 1, doi. 10.1002/ange.202206680
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- Article
Medium Diradical Character, Small Hole and Electron Reorganization Energies and Ambipolar Transistors in Difluorenoheteroles.
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- Angewandte Chemie International Edition, 2022, v. 61, n. 33, p. 1, doi. 10.1002/anie.202206680
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- Article
Raman Activities of Cyano-Ester Quinoidal Oligothiophenes Reveal Their Diradical Character and the Proximity of the Low-Lying Double Exciton State.
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- Chemistry (2624-8549), 2022, v. 4, n. 2, p. 329, doi. 10.3390/chemistry4020025
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- Article
Impact of Charge-Resonance Excitations on CT-Mediated J-Type Aggregation in Singlet and Triplet Exciton States of Perylene Di-Imide Aggregates: A TDDFT Investigation.
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- Computation, 2022, v. 10, n. 2, p. 18, doi. 10.3390/computation10020018
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- Article
Normal & reversed spin mobility in a diradical by electron-vibration coupling.
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- Nature Communications, 2021, v. 12, n. 1, p. 1, doi. 10.1038/s41467-021-26368-8
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- Article
Impact of Fluoroalkylation on the n-Type Charge Transport of Two Naphthodithiophene Diimide Derivatives.
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- Molecules, 2021, v. 26, n. 14, p. 4119, doi. 10.3390/molecules26144119
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- Article
Addressing the Elusive Polaronic Nature of Multiple Redox States in a π‐Conjugated Ladder‐Type Polymer.
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- Advanced Electronic Materials, 2021, v. 7, n. 1, p. 1, doi. 10.1002/aelm.202000786
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- Article
Insights into the mechanism of coreactant electrochemiluminescence facilitating enhanced bioanalytical performance.
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- Nature Communications, 2020, v. 11, n. 1, p. 1, doi. 10.1038/s41467-020-16476-2
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- Article
Dodecatwistarene Imides with Zigzag‐Twisted Conformation for Organic Electronics.
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- Angewandte Chemie, 2020, v. 132, n. 5, p. 2024, doi. 10.1002/ange.201912356
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- Article
Dodecatwistarene Imides with Zigzag‐Twisted Conformation for Organic Electronics.
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- Angewandte Chemie International Edition, 2020, v. 59, n. 5, p. 2008, doi. 10.1002/anie.201912356
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- Article
The Low Lying Double-Exciton State of Conjugated Diradicals: Assessment of TDUDFT and Spin-Flip TDDFT Predictions.
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- Computation, 2019, v. 7, n. 4, p. 68, doi. 10.3390/computation7040068
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- Article
Perylene π‐Bridges Equally Delocalize Anions and Cations: Proportioned Quinoidal and Aromatic Content.
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- Angewandte Chemie, 2019, v. 131, n. 41, p. 14609, doi. 10.1002/ange.201905657
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- Article
Perylene π‐Bridges Equally Delocalize Anions and Cations: Proportioned Quinoidal and Aromatic Content.
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- Angewandte Chemie International Edition, 2019, v. 58, n. 41, p. 14467, doi. 10.1002/anie.201905657
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- Article
A model hamiltonian tuned toward high level ab initio calculations to describe the character of excitonic states in perylenebisimide aggregates.
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- Journal of Computational Chemistry, 2018, v. 39, n. 24, p. 1979, doi. 10.1002/jcc.25374
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- Article
Hierarchical Growth of Supramolecular Structures Driven by Pimerization of Tetrahedrally Arranged Bipyridinium Units.
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- Chemistry - A European Journal, 2017, v. 23, n. 26, p. 6380, doi. 10.1002/chem.201700137
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- Article
Modeling p-type charge transport in thienoacene analogs of pentacene.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 2, p. 1, doi. 10.1007/s00214-015-1757-9
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Molecular Size and Electronic Structure Combined Effects on the Electrogenerated Chemiluminescence of Sulfurated Pyrene-Cored Dendrimers.
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- Chemistry - A European Journal, 2015, v. 21, n. 7, p. 2936, doi. 10.1002/chem.201404230
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- Article
A Highly Luminescent Tetramer from a Weakly Emitting Monomer: Acid- and Redox-Controlled Multiple Complexation by Cucurbit[7]uril.
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- Chemistry - A European Journal, 2014, v. 20, n. 23, p. 7054, doi. 10.1002/chem.201400375
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- Article
Photophysical Properties and Conformational Effects on the Circular Dichroism of an Azobenzene-Cyclodextrin [1]Rotaxane and Its Molecular Components.
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- Chemistry - A European Journal, 2013, v. 19, n. 9, p. 3131, doi. 10.1002/chem.201203676
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- Article
Localization/Delocalization of Charges in Bay-Linked Perylene Bisimides.
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- Chemistry - A European Journal, 2012, v. 18, n. 22, p. 6764, doi. 10.1002/chem.201103954
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- Article
Biradicaloid Character of Thiophene-Based Heterophenoquinones: The Role of Electron-Phonon Coupling.
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- ChemPhysChem, 2010, v. 11, n. 17, p. 3685, doi. 10.1002/cphc.201000675
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- Article
Raman spectroscopic characterization of a thiophene-based active material for resistive organic nonvolatile memories.
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- Journal of Raman Spectroscopy, 2010, v. 41, n. 4, p. 406, doi. 10.1002/jrs.2449
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Tuning the physisorption of molecular hydrogen: binding to aromatic, hetero-aromatic and metal-organic framework materials.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2007, v. 118, n. 1, p. 149, doi. 10.1007/s00214-007-0254-1
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Light driven molecular switches: exploring and tuning their photophysical and photochemical properties.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2007, v. 117, n. 5/6, p. 1041, doi. 10.1007/s00214-006-0219-9
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- Article
Photochemical and Electronic Properties of Conjugated Bis(azo) Compounds: An Experimental and Computational Study.
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- Chemistry - A European Journal, 2004, v. 10, n. 8, p. 2011, doi. 10.1002/chem.200305590
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Rational Design of Helical Columnar Packing in Single Crystals ( This work was financially supported by the Zentrum für Multifunktionelle Werkstoffe und Miniaturisierte Funktionseinheiten (BMBF 03N 6500), EU-TMR project SISITOMAS, the Deutsche Forschungsgemeinschaft (Schwerpunkt Feldeffekttransistoren), and the EU project DISCEL (G5RD-CT-2000-00321). )
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- Angewandte Chemie International Edition, 2004, v. 43, n. 15, p. 1972, doi. 10.1002/anie.200353245
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- Article
Rational Design of Helical Columnar Packing in Single Crystals ( This work was financially supported by the Zentrum für Multifunktionelle Werkstoffe und Miniaturisierte Funktionseinheiten (BMBF 03N 6500), EU-TMR project SISITOMAS, the Deutsche Forschungsgemeinschaft (Schwerpunkt Feldeffekttransistoren), and the EU project DISCEL (G5RD-CT-2000-00321). )
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- Angewandte Chemie, 2004, v. 116, n. 15, p. 2006, doi. 10.1002/ange.200353245
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- Article
Infrared and Raman spectra of binuclear aromatic molecules: a density functional theory study.
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- Journal of Raman Spectroscopy, 1998, v. 29, n. 6, p. 501, doi. 10.1002/(SICI)1097-4555(199806)29:6<501::AID-JRS270>3.0.CO;2-N
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- Article