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Molecular Simulation Volume 32, 2006 - Issue 9: Electron transfer
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Original Articles

Charge dynamics through pi-stacked arrays of conjugated molecules: effect of dynamic disorder in different transport/transfer regimes

A. Troisi Department of Chemistry and Centre of Scientific Computing, University of Warwick, CV4 7AL, Coventry, UKCorrespondence[email protected]
Pages 707-716 | Received 01 Apr 2006, Accepted 01 May 2006, Published online: 31 Jan 2007

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Ferdinand C. Grozema & Laurens D.A. Siebbeles. (2008) Mechanism of charge transport in self-organizing organic materials. International Reviews in Physical Chemistry 27:1, pages 87-138.
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Articles from other publishers (20)

Deep Mukherjee & Upendra Harbola. (2021) Photo-Ionization Time Delay in Linearly Extended π-Conjugated Molecular Systems. The Journal of Physical Chemistry A 125:38, pages 8417-8425.
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Xuyan Ru, Peng Zhang & David N. Beratan. (2019) Assessing Possible Mechanisms of Micrometer-Scale Electron Transfer in Heme-Free Geobacter sulfurreducens Pili . The Journal of Physical Chemistry B 123:24, pages 5035-5047.
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Beth Rice, Anne A. Y. Guilbert, Jarvist M. Frost & Jenny Nelson. (2018) Polaron States in Fullerene Adducts Modeled by Coarse-Grained Molecular Dynamics and Tight Binding. The Journal of Physical Chemistry Letters 9:22, pages 6616-6623.
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Bailey E. Risteen, Alyssa Blake, Michael A. McBride, Cornelia Rosu, Jung Ok Park, Mohan Srinivasarao, Paul S. Russo & Elsa Reichmanis. (2017) Enhanced Alignment of Water-Soluble Polythiophene Using Cellulose Nanocrystals as a Liquid Crystal Template. Biomacromolecules 18:5, pages 1556-1562.
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Mohamad Insan Nugraha, Hiroyuki Matsui, Shun Watanabe, Takayoshi Kubo, Roger H?usermann, Satria Zulkarnaen Bisri, Mykhailo Sytnyk, Wolfgang Heiss, Maria Antonietta Loi & Jun Takeya. (2017) Strain-Modulated Charge Transport in Flexible PbS Nanocrystal Field-Effect Transistors. Advanced Electronic Materials 3:1, pages 1600360.
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Satoshi Kera, Hiroyuki Yamane & Nobuo Ueno. 2015. Electronic Processes in Organic Electronics. Electronic Processes in Organic Electronics 27 49 .
Sofia Canola & Fabrizia Negri. (2014) Anisotropy of the n-type charge transport and thermal effects in crystals of a fluoro-alkylated naphthalene diimide: a computational investigation. Phys. Chem. Chem. Phys. 16:39, pages 21550-21558.
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Jin‐Dou Huang, Shu‐Hao Wen & Ke‐Li Han. (2012) First‐Principles Investigation of the Electronic and Conducting Properties of Oligothienoacenes and their Derivatives. Chemistry – An Asian Journal 7:5, pages 1032-1040.
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Simone Di Motta, Melania Siracusa & Fabrizia Negri. (2011) Structural and Thermal Effects on the Charge Transport of Core-Twisted Chlorinated Perylene Bisimide Semiconductors. The Journal of Physical Chemistry C 115:42, pages 20754-20764.
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Philipp Mücke, Manfred Zabel, Ruth Edge, David Collison, Sébastien Clément, Stanislav Záliš & Rainer F. Winter. (2011) Electron delocalization in vinyl ruthenium substituted cyclophanes: Assessment of the through-space and the through-bond pathways. Journal of Organometallic Chemistry 696:20, pages 3186-3197.
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David P. McMahon & Alessandro Troisi. (2010) Organic Semiconductors: Impact of Disorder at Different Timescales. ChemPhysChem 11:10, pages 2067-2074.
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Wolfgang L. Kalb, Simon Haas, Cornelius Krellner, Thomas Mathis & Bertram Batlogg. (2010) Trap density of states in small-molecule organic semiconductors: A quantitative comparison of thin-film transistors with single crystals. Physical Review B 81:15.
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Satoshi Kera, Hiroyuki Yamane & Nobuo Ueno. (2009) First-principles measurements of charge mobility in organic semiconductors: Valence hole?vibration coupling in organic ultrathin films. Progress in Surface Science 84:5-6, pages 135-154.
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Alessandro Troisi. 2010. Organic Electronics. Organic Electronics 213 258 .
Khatcharin Siriwong & Alexander A. Voityuk. (2008) π Stack Structure and Hole Transfer Couplings in DNA Hairpins and DNA. A Combined QM/MD Study. The Journal of Physical Chemistry B 112:27, pages 8181-8187.
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Alexander A. Voityuk & Miquel Duran. (2008) Buckycatcher. A New Opportunity for Charge-Transfer Mediation?. The Journal of Physical Chemistry C 112:5, pages 1672-1678.
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J. J. Kwiatkowski, J. Nelson, H. Li, J. L. Bredas, W. Wenzel & C. Lennartz. (2008) Simulating charge transport in tris(8-hydroxyquinoline) aluminium (Alq3). Physical Chemistry Chemical Physics 10:14, pages 1852.
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Alexander A. Voityuk. (2008) Charge-on-site scheme to estimate the electronic coupling in electron transfer systems. Chemical Physics Letters 451:1-3, pages 153-157.
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Eung-Gun Kim, Veaceslav Coropceanu, Nadine E. Gruhn, Roel S. Sánchez-Carrera, Robert Snoeberger, Adam J. Matzger & Jean-Luc Brédas. (2007) Charge Transport Parameters of the Pentathienoacene Crystal. Journal of the American Chemical Society 129:43, pages 13072-13081.
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Alexander A. Voityuk. (2007) Fluctuation of the electronic coupling in DNA: Multistate versus two-state model. Chemical Physics Letters 439:1-3, pages 162-165.
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