Polaron properties in armchair graphene nanoribbons

WF Da Cunha, PH Acioli… - The Journal of …, 2016 - ACS Publications
By means of a 2-D tight-binding model with lattice relaxation in a first-order expansion, we
report different polaron properties depending on the armchair graphene nanoribbons width …

Thermally-induced charge carrier population control on graphene nanoribbons

TSA Cassiano, GM e Silva, PH de Oliveira Neto - Materials Advances, 2024 - pubs.rsc.org
Organic thermoelectric devices allow the conversion of heat into electricity in a sustainable
way, making them strong candidates to solve the present energy crisis. In this context …

Phase transition of polarons in bilayer graphene nanoribbons

TSA Cassiano, GM e Silva, PH de Oliveira Neto - Physica Scripta, 2023 - iopscience.iop.org
Stacking graphene nanoribbons (GNRs) is the natural path to obtain semiconductors with
exotic quantum phenomena by manipulating the interlayer coupling. Recently, a report …

Same charge polaron and bipolaron scattering on conducting polymers

MB Falleiros, GM e Silva - The Journal of Physical Chemistry A, 2019 - ACS Publications
We study the dynamics of scattering of two positive polarons moving toward each other with
parallel spins and of a polaron and a bipolaron both with positive charges and different …

Reactive scattering between excitons and charge carriers in conjugated polymers

WF da Cunha, LA Ribeiro Jr, ALA Fonseca… - The Journal of …, 2014 - ACS Publications
The temperature influence on the scattering process between an exciton and a positively
charged carrier (polaron or bipolaron) is theoretically investigated using a version of the Su …

Temperature effects on the scattering of polarons and bipolarons in organic conductors

LA Ribeiro Junior, WF da Cunha… - The Journal of Physical …, 2014 - ACS Publications
The scattering process between an electron-polaron and a hole-bipolaron has been
simulated using a version of the Su–Schrieffer–Heeger (SSH) model modified to include an …

[HTML][HTML] Temperature effects on intrachain recombination of bipolarons in conjugated polymers

LAR Junior, WF da Cunha… - Chemical Physics …, 2014 - Elsevier
The temperature influence over the intrachain recombination dynamics between oppositely
charged bipolarons has been theoretically investigated using a version of the Su–Schrieffer …

Activation energies and diffusion coefficients of polarons and bipolarons in organic conductors

PH de Oliveira Neto, LE de Sousa - The Journal of Physical …, 2018 - ACS Publications
Intrachain diffusion of charge carriers in organic conductors is analyzed. Using a tight-
binding model Hamiltonian that includes strong electron–phonon coupling combined with a …

Temperature effects on the dynamics of oppositely charged bipolarons scattering in conjugated polymers

JJ Liu, Y Meng, YP Luo, YL Zhang, B Di - The European Physical Journal …, 2023 - Springer
Within a tight-binding electron–phonon interaction model modified to include temperature
effects, the dynamics of two oppositely charged bipolarons scattering in conjugated …