Literature DB >> 23676026

Polaron dynamics in a two-dimensional Holstein-Peierls system.

E Mozafari1, S Stafström.   

Abstract

A semiclassical model for studying charge transport in a two-dimensional molecular lattice is presented and applied to both a well ordered system and a system with disorder. The model includes both intra- and inter-molecular electron-lattice interactions and the focus of the studies is to describe the dynamics of a charge carrier in the system. In particular, we study the dynamics of the system in which the polaron solution is dynamically stable. It is found that the parameter space for which the polaron is moving through the system is quite restricted and that the polaron is immobile for large electron-phonon coupling and weak intermolecular electron interactions and dynamically unstable and disassociates into a delocalized electronic state decoupled from the lattice for small electron-phonon coupling and strong intermolecular electron interactions. Disorder further limits the parameter space in which the polaron is mobile.

Year:  2013        PMID: 23676026     DOI: 10.1063/1.4803691

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  5 in total

1.  Polaron properties in 2D organic molecular crystals: directional dependence of non-local electron-phonon coupling.

Authors:  Marcelo Lopes Pereira Junior; Rafael Timóteo de Sousa Júnior; Bernhard Georg Enders Neto; Geraldo Magela E Silva; Luiz Antonio Ribeiro Junior
Journal:  J Mol Model       Date:  2019-05-07       Impact factor: 1.810

2.  Polaron dynamics in oligoacene stacks.

Authors:  Marcelo Lopes Pereira Junior; Luiz Antonio Ribeiro Junior
Journal:  J Mol Model       Date:  2017-08-08       Impact factor: 1.810

3.  Polaron stability in oligoacene crystals.

Authors:  Marcelo Lopes Pereira Junior; Luiz Antonio Ribeiro Junior
Journal:  J Mol Model       Date:  2017-02-22       Impact factor: 1.810

4.  Quasiparticle dynamics by effective [Formula: see text]-field distortion.

Authors:  Tiago de Sousa Araújo Cassiano; Pedro Henrique de Oliveira Neto; Geraldo Magela E Silva
Journal:  Sci Rep       Date:  2022-05-13       Impact factor: 4.996

5.  Dynamical Mechanism of Polarons and Bipolarons in Poly(p-Phenylene Vinylene).

Authors:  Fábio Luís de Oliveira Paula; Leonardo Luiz E Castro; Luiz Antonio Ribeiro Junior; Rafael Timóteo de Sousa Júnior; Geraldo Magela E Silva; Pedro Henrique de Oliveira Neto
Journal:  Sci Rep       Date:  2019-12-02       Impact factor: 4.379

  5 in total

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