Starting from the Hamiltonian for a dimer which includes all the electronic and electron-phonon terms consistent with a non-degenerate orbital, by a sequence of displacement and squeezing transformation we obtain an effective polaronic Hamiltonian. The renormalized electronic interactions differ from the results of semiclassical or perturbative treatments. The properties of the variationally determined ground state of two particles in the orbital are discussed for variable dimer length in the adiabatic limit
The dimerization of polyacetylene is studied using a distance-dependent Hubbard Hamiltonian for the valence $\ensuremath{\pi}$ electrons and approximating $\ensuremath{\sigma}$-electron contributions by a sum of pair interactions ${E}_{\ensuremath{\sigma}}{(r}_{\mathrm{ij}})$. The $\ensuremath{\pi}$-electron Coulomb repulsion
U is taken to be independent of the C-C distances
rij and is varied systematically from the uncorrelated or H\"uckel limit all over to the strongly correlated or Heisenberg regime. For each value of
U, ${E}_{\ensuremath{\sigma}}{(r}_{\mathrm{ij}})$, and the $\ensuremath{\pi}$-electron hopping integral
t(rij) are fitted to reproduce ab initio results on the ground-state and first-excited-state energy of the ethylene molecule. The one-dimensional many-body problem is solved numerically by means of the density-matrix renormalization-group (DMRG) method. The ground-state energy
E of the infinite open polymer is obtained by extrapolation considering chains of up to 300 atoms. The dimerization $\ensuremath{\delta}{=(r}_{i,i+1}\ensuremath{-}{r}_{i\ensuremath{-}1,i})/2$ and the average bond length ${R=(r}_{i,i+1}{+r}_{i\ensuremath{-}1,i})/2$ are determined by minimizing
E. While
R is not significantly affected by the value of
U, $\ensuremath{\delta}$ shows a remarkable nonmonotonic behavior. The differences between the delocalized regime, small
U/t, and spin-Peierls behavior, large
U/t, are discussed. The convergence properties of the DMRG algorithm are analyzed as a function of
U, $\ensuremath{\delta}$, and the number states kept at each RG step. Criteria are examined in order to control the accuracy of the DMRG calculations in both weakly and strongly correlated situations.
We present a density matrix renormalization group study of the doped one-dimensional (1D) Hubbard-Su-Schrieffer-Heeger (Hubbard-SSH) model, where the atomic displacements linearly modulate the nearest-neighbor hopping integrals. Focusing on an optical variant of the model in the strongly correlated limit relevant for cuprate spin chains, we examine how the SSH interaction modifies the model's ground- and excited-state properties. The SSH coupling weakly renormalizes the model's single- and two-particle response functions for electron-phonon $(e\text{\ensuremath{-}}\mathrm{ph})$ coupling strengths below a parameter-dependent critical value
gc. For larger $e\text{\ensuremath{-}}\mathrm{ph}$ coupling, the sign of the effective hopping integrals changes for a subset of orbitals, which drives a lattice dimerization distinct from the standard nesting-driven picture in 1D. The spectral weight of the one- and two-particle dynamical response functions are dramatically rearranged across this transition, with significant changes in the ground-state correlations. We argue that this dimerization results from the breakdown of the linear approximation for the $e\text{\ensuremath{-}}\mathrm{ph}$ coupling and thus signals a fundamental limitation of the linear SSH interaction. Our results have consequences for our understanding of how SSH-like interactions can enter the physics of strongly correlated quantum materials, including the recently synthesized doped cuprate spin chains.
In this paper we derive the finite size corrections to the energy eigenvalues of the energy for 2D dimers on a square lattice. These finite size corrections, as in the case of Critical Dense Polymers, are proportional to the eigenvalues of the Local Integrals of Motion of Bazhanov Lukyanov and Zamolodchikov for central charge
c=−2. This sheds more light on the status of the Dimer model as a conformal field theory with this value of the certral charge.