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Unraveling the effect of defects, domain size, and chemical doping on photophysics and charge transport in covalent organic frameworks

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Connecting the dots for fundamental understanding of structure–photophysics–property relationships of COFs, MOFs, and perovskites using a Multiparticle Holstein Formalism

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Strategies and concepts in n-doped conjugated polymer thermoelectrics

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Introducing the new concept of a chiral-polaron giant-IRAV signature, optical-active giant-response in vibrational circular dichroism

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Raman Snapshots of Side-Chain Dependent Polaron Dynamics in PolyThiophene Films

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Nitrogen atom free polythiophene derivative as an efficient chemosensor for highly selective and sensitive Cu2+ and Ag+ detection

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Does the Traditional Band Picture Describe the Electronic Structure of Doped Conjugated Polymers? TD-DFT and Natural Transition Orbital Study of Doped P3HT

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Experimental and Theoretical Investigation into the Polaron Structure of K-Doped Polyfluorene Films

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Unraveling Excited State Dynamics of a Single-Stranded DNA-Assembled Conjugated Polyelectrolyte

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Spectral Signatures and Spatial Coherence of Bound and Unbound Polarons in P3HT Films: Theory Versus Experiment

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Dynamics of Short-Lived Polaron Pairs and Polarons in Polythiophene Derivatives Observed via Infrared-Activated Vibrations

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Enhanced charge separation by interchain hole delocalization in nonfullerene acceptor‐based bulk heterojunction materials

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Nonradiative Recombination via Charge‐Transfer‐Exciton to Polaron Energy Transfer Limits Photocurrent in Organic Solar Cells

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Advanced Energy Materials, 2022, 12
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Polaron Delocalization Dependence of the Conductivity and the Seebeck Coefficient in Doped Conjugated Polymers

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Fabricated Cu2Zn SnS4 (CZTS) nanoparticles as an additive in P3HT: PCBM active layer for efficiency improvement of polymer solar cell

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Spectral Signatures of a Negative Polaron in a Doped Polymer Semiconductor: Energy Levels and Hubbard U Interactions

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Favorable Mixing Thermodynamics in Ternary Polymer Blends for Realizing High Efficiency Plastic Solar Cells

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Advanced Energy Materials, 2019, 9
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Evidence for Photoinduced Polaron Generation in a High Persistence Length Low Bandgap Conjugated Polymer in Solution

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Proquinoidal-Conjugated Polymer as an Effective Strategy for the Enhancement of Electrical Conductivity and Thermoelectric Properties

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Anisotropic Polaron Delocalization in Conjugated Homopolymers and Donor–Acceptor Copolymers

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Chem. Mater., 2019, 31, 7033
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Ultrafast Transient Absorption Studies of the Dynamics of Free and Coulombically Trapped Polarons in Doped Conjugated Polymers

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Does the Traditional Band Picture Correctly Describe the Electronic Structure of n-Doped Conjugated Polymers? A TD-DFT and Natural Transition Orbital Study

Eric C. Wu and Benjamin J. Schwartz

J. Chem. Theory Comput., 2024, 20, 10059
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