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Exploring thermal transitions in anthradithiophene-based organic semiconductors to reveal structure-packing relationships

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The influence of alkyl group regiochemistry and backbone fluorination on the packing and transistor performance of N-cyanoimine functionalised indacenodithiophenes

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Mater. Adv., 2021, 2, 1706
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Crystal engineering of alkylethynyl fluoroanthradithiophenes

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Mol. Syst. Des. Eng., 2022, 7, 374
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Which isomer is better for charge transport: anti- or syn-?

Peng Hu, Jun Ye and Hui Jiang

J. Mater. Chem. C, 2019, 7, 5858
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Charge transport in highly ordered organic nanofibrils: lessons from modelling

Ganna Gryn’ova, Adrien Nicolaï, Antonio Prlj, Pauline Ollitrault, Denis Andrienko and Clemence Corminboeuf

J. Mater. Chem. C, 2017, 5, 350
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Influence of non-covalent interactions in dictating the polarity and mobility of charge carriers in a series of crystalline NDIs: a computational case study

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RSC Adv., 2021, 11, 33703
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Computationally aided design of a high-performance organic semiconductor: the development of a universal crystal engineering core

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Chem. Sci., 2019, 10, 10543
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syn/anti‐Oligothienoacene Diimides with up to 10 Fused Rings

Jingjing Wen, Fei Qiu, Han Liu, Xinyue Liu, Hui Hu, Yuxiao Duan, Zhaohui Wang and Lei Zhang

Angew Chem Int Ed, 2022, 61
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Theory-Driven Insight into the Crystal Packing of Trialkylsilylethynyl Pentacenes

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Chem. Mater., 2017, 29, 2502
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Structure–Property Correlation behind the High Mobility of Carbazolocarbazole

Miriam Más-Montoya, Stamatis Georgakopoulos, José Pedro Cerón-Carrasco, José Pérez, Alberto Tárraga and David Curiel

J. Phys. Chem. C, 2018, 122, 11736
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Heterotetracenes: Flexible Synthesis and in Silico Assessment of the Hole‐Transport Properties

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Chemistry A European J, 2017, 23, 8058
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The Influence of Isomer Purity on Trap States and Performance of Organic Thin‐Film Transistors

Peter J. Diemer, Jacori Hayes, Evan Welchman, Rawad Hallani, Sujitra J. Pookpanratana, Christina A. Hacker, Curt A. Richter, John E. Anthony, Timo Thonhauser and Oana D. Jurchescu

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Synthesis and Properties of New N‐Heteroheptacenes for Solution‐Based Organic Field Effect Transistors

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Chemistry A European J, 2017, 23, 12542
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From Linear to Angular Isomers: Achieving Tunable Charge Transport in Single‐Crystal Indolocarbazoles Through Delicate Synergetic CH/NH⋅⋅⋅π Interactions

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Crystal Structures of β-Methylchalcogenated Tetrathienoacenes: From One-Dimensional π-Stacking to Sandwich Pitched π-Stacking Structure

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syn/anti‐Oligothienoacene Diimides with up to 10 Fused Rings

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Theoretical Investigations on Molecular Packing Motifs and Charge Transport Properties of a Family of Trialkylsilylethynyl-Modified Pentacenes/Anthradithiophenes

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J. Phys. Chem. C, 2018, 122, 18880
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The role of crystal packing on the optical response of trialkyltetrelethynyl acenes

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The Journal of Chemical Physics, 2022, 157
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Pitched π-Stacking Crystal Structure and Two-Dimensional Electronic Structure of Acenaphtho[1,2-k]fluoranthene Analogues with Various Substituents

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Crystal Growth & Design, 2024, 24, 1849
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Noncovalent Molecular Electronics

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Understanding the Crystal Packing and Organic Thin‐Film Transistor Performance in Isomeric Guest–Host Systems

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Advanced Materials, 2017, 29
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From Linear to Angular Isomers: Achieving Tunable Charge Transport in Single‐Crystal Indolocarbazoles Through Delicate Synergetic CH/NH⋅⋅⋅π Interactions

Hui Jiang, Peng Hu, Jun Ye, Apoorva Chaturvedi, Keke K. Zhang, Yongxin Li, Yi Long, Denis Fichou, Christian Kloc and Wenping Hu

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Implications of Charge Penetration for Heteroatom-Containing Organic Semiconductors

Ganna Gryn’ova and Clemence Corminboeuf

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Read between the Molecules: Computational Insights into Organic Semiconductors

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J. Am. Chem. Soc., 2018, 140, 16370
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Interfacial and bulk charge transport in indolo[2,3-a]carbazole

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Synthetic Metals, 2020, 261, 116308
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Design Rules to Optimize the Intermolecular and Long-Range Packing of Organic Semiconductor Crystals

Farahnaz Maleki, Karl J. Thorley, Hamna F. Iqbal, Daniel Vong, Toulik Maitra, Anthony Petty, Luke L. Daemen, Sean R. Parkin, Oana D. Jurchescu, John E. Anthony and Adam J. Moulé

Chem. Mater., 2024, 36, 4794
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