An overview of the theory of π-conjugated polymers

D Baeriswyl, DK Campbell, S Mazumdar - Conjugated conducting …, 1992 - Springer
We review recent advances in the theoretical modelling of π-conjugated polymers. Our
emphasis is on quasi-one-dimensional π-electron models that include both electron-phonon …

Quantum Monte Carlo simulations of the Davydov model

X Wang, DW Brown, K Lindenberg - … Self-Trapping of Vibrational Energy in …, 1990 - Springer
Through an application of the quantum Monte Carlo technique, we investigate the thermal
equilibrium properties of the one-dimensional model proposed by Davydov for the …

Variational energy band theory for polarons: Mapping polaron structure with the Toyozawa method

Y Zhao, DW Brown, K Lindenberg - The Journal of chemical physics, 1997 - pubs.aip.org
In this article we revisit from a contemporary perspective a classic problem of polaron theory
in one space dimension following the variational approach originally taken by Toyozawa …

Polaron effective mass, band distortion, and self-trapping in the Holstein molecular-crystal model

AH Romero, DW Brown, K Lindenberg - Physical Review B, 1999 - APS
We present polaron effective masses and selected polaron band structures of the Holstein
molecular crystal model in one dimension as computed by the Global-Local variational …

Effects of dimensionality and anisotropy on the Holstein polaron

AH Romero, DW Brown, K Lindenberg - Physical Review B, 1999 - APS
We apply weak-coupling perturbation theory and strong-coupling perturbation theory to the
Holstein molecular crystal model in order to elucidate the effects of anisotropy on polaron …

Migration of Holstein Polarons in Anatase TiO2

L Yan, H Chen - Journal of Chemical Theory and Computation, 2014 - ACS Publications
A simple yet reliable valence bond theory was applied to ascertain the effective size and
shape for the electron and hole polarons in bulk anatase TiO2 by examining the extent of …

One-dimensional nonlinear Schrödinger equation: A nonlinear dynamical approach

Y Wan, CM Soukoulis - Physical Review A, 1990 - APS
We have studied a time-independent nonlinear Schrödinger equation of the tight-binding
form on a one-dimensional lattice. The real and complex wave functions as solutions to the …

Calculation of excited polaron states in the Holstein model

OS Barišić - Physical Review B, 2004 - APS
An exact-diagonalization technique is used to investigate the low-lying excited polaron
states in the Holstein model for the infinite one-dimensional lattice. For moderate values of …

Variational energy band theory for polarons: mapping polaron structure with the global-local method

DW Brown, K Lindenberg, Y Zhao - The Journal of chemical physics, 1997 - pubs.aip.org
In this paper we revisit from a contemporary perspective a classic problem of polaron theory
in one dimension using a new variational approach generalizing that of Toyozawa, based …

Alternative approach to the dynamics of polarons in one dimension

AHC Neto, AO Caldeira - Physical Review B, 1992 - APS
We developed a method based on functional integration to treat the dynamics of polarons in
one-dimensional systems. We treat the acoustical and the optical case in a unified manner …