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J H Samson

Publications and source records attributed to J H Samson.

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Strictly localised triplet dimers on one- and two-dimensional lattices

Electrons may form inter-site pairs (dimers) by a number of mechanisms. For example, long-range (Fröhlich) electron-phonon interactions and strong on-site Hubbard U allow formation of small light bipolarons in some lattices. We identify circumstances under which triplet dimers are strictly localised by interference in certain one- and two-dimensional lattices. We assume a U-V Hamiltonian with nearest- and next-nearest-neighbour hopping integrals t and t', large positive U and attractive nearest- and next-nearest-neighbour interactions V and V'. In the square ladder and some two-dimensional bilayers, if the dimer Hilbert space is restricted to nearest- and next-nearest-neighbour dimers, triplet dimers become strictly localised for certain values of these parameters. For example, in a square ladder with t' = t and V' = V, all triplet bands become flat due to exact cancellation of hopping paths. We identify the localised eigenstates for all flat bands in each lattice. We show that many of the flat bands persist for arbitrary t/ t' so long as other restrictions still apply.

cond-mat.str-el

Coherent-state path integral calculation of the Wigner function

We consider a set of operators hat{x}=(hat{x}_1,..., hat{x}_N) with diagonal representatives P(n) in the space of generalized coherent states |n>; hat{x}=int dn P(n) |n> _L over polygonal paths with L vertices {n_1...L}. The distribution of the path centroid bar{P}=(1/L) sum_{i=1}^{L}P(n_i) tends to the Wigner function W(x), the joint distribution for the operators: W(x)=lim_{L->infinity} _{L}. This result is proved in the case where the Hamiltonian commutes with hat{x}. The Wigner function is non-positive if the dominant paths with path centroid in a certain region have Berry phases close to odd multiples of pi. For finite L the path centroid distribution is a Wigner function convolved with a Gaussian of variance inversely proportional to L. The results are illustrated by numerical calculations of the spin Wigner function from SU(2) coherent states. The relevance to the quantum Monte Carlo sign problem is also discussed.

quant-ph

Exact Classical Effective Potential

A quantum spin system can be modelled by an equivalent classical system, with an effective Hamiltonian obtained by integrating all non-zero frequency modes out of the path integral. The effective Hamiltonian H_eff(S_i) derived from the coherent-state integral is highly singular: the quasiprobability density exp(-beta H_eff), a Wigner function, imposes quantisation through derivatives of delta functions. This quasiprobability is the distribution of the time-averaged lower symbol of the spin in the coherent-state integral. We relate the quantum Monte Carlo minus-sign problem to the non-positivity of this quasiprobability, both analytically and by Monte Carlo integration.

quant-ph

Spin density wave selection in the one-dimensional Hubbard model

The Hartree-Fock ground state phase diagram of the one-dimensional Hubbard model is calculated, constrained to uniform phases, which have no charge density modulation. The allowed solutions are saturated ferromagnetism (FM), a spiral spin density wave (SSDW) and a double spin density wave} (DSDW). The DSDW phase comprises two canted interpenetrating antiferromagnetic sublattices. FM occurs for small filling, SSDW in most of the remainder of the phase diagram, and DSDW in a narrow tongue near quarter (and three-quarter) filling. Itinerant electrons lift the degeneracy with respect to canting angle in the DSDW. The Hartree-Fock states are metallic except at multiples of a quarter filling. Near half filling the uniform SSDW phase is unstable against phase separation into a half-filled antiferromagnetic phase and a hole-rich SSDW phase. The dependence of the ground state wave number on chemical potential is conjectured to be a staircase. Comparison is made with higher dimensional Hubbard models and the $J_{1}-J_{2}$ Heisenberg model.

cond-mat