Using a symmetrized density-matrix renormalization-group formulation, we have investigated the electronic binding energy of the lowest optically allowed exciton (1Bu) within an extended Hubbard-Peierls model (with parameters U, V, and δ) for conjugated chains with N=80 sites. Three symmetries, the C2, spin parity, and electron-hole symmetries, have been applied to construct the projector operator. Analysis of our results on the ratios between exciton binding energies and exciton energies, sheds light on the current experimental and theoretical controversy on exciton binding for polyacetylene and polyparaphenylene vinylene. We show that in the absence of dimerization, the exciton binding energy is vanishi...
Starting from the Pariser-Parr-Pople model of π conjugated systems, a model of the low-lying excitat...
We introduce a mapping from configuration interaction singles wavefunctions, expressed as linear com...
The two-state molecular orbital model of the one-dimensional phenyl-based semiconductors is applied ...
By applying the numerically accurate symmetrized density-matrix renormalization-group method cou...
Using a symmetrized density matrix renormalization group formulation, we have investigated the e...
Using a symmetrized density matrix renormalization group formulation, we have investigated the elect...
We present a theoretical and computational analysis of excitons in conjugated polymers. We use a tig...
Starting from the Pariser-Parr-Pople theory of π-conjugated systems, we construct a model of the low...
We present density-matrix renormalization-group calculations of the Pariser-Parr-Pople-Peierls model...
The ground and low-lying states of finite quantum-cell models with one state per site are obtained e...
The spatial extension and binding energy of excitons in semiconducting conjugated polymers are still...
Using a recently developed phenomenological Hamiltonian of poly(para-phenylene) and the density matr...
Motivated by the reported enhanced singlet exciton yield in light-emitting polymers, we investigate ...
The density matrix renormalization group method is applied to the Pariser-Parr-Pople-Peierls model t...
It is shown formally that the Peierls expression is inadequate for studying the instabilities of a p...
Starting from the Pariser-Parr-Pople model of π conjugated systems, a model of the low-lying excitat...
We introduce a mapping from configuration interaction singles wavefunctions, expressed as linear com...
The two-state molecular orbital model of the one-dimensional phenyl-based semiconductors is applied ...
By applying the numerically accurate symmetrized density-matrix renormalization-group method cou...
Using a symmetrized density matrix renormalization group formulation, we have investigated the e...
Using a symmetrized density matrix renormalization group formulation, we have investigated the elect...
We present a theoretical and computational analysis of excitons in conjugated polymers. We use a tig...
Starting from the Pariser-Parr-Pople theory of π-conjugated systems, we construct a model of the low...
We present density-matrix renormalization-group calculations of the Pariser-Parr-Pople-Peierls model...
The ground and low-lying states of finite quantum-cell models with one state per site are obtained e...
The spatial extension and binding energy of excitons in semiconducting conjugated polymers are still...
Using a recently developed phenomenological Hamiltonian of poly(para-phenylene) and the density matr...
Motivated by the reported enhanced singlet exciton yield in light-emitting polymers, we investigate ...
The density matrix renormalization group method is applied to the Pariser-Parr-Pople-Peierls model t...
It is shown formally that the Peierls expression is inadequate for studying the instabilities of a p...
Starting from the Pariser-Parr-Pople model of π conjugated systems, a model of the low-lying excitat...
We introduce a mapping from configuration interaction singles wavefunctions, expressed as linear com...
The two-state molecular orbital model of the one-dimensional phenyl-based semiconductors is applied ...