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Il Nuovo cimento della Società italiana di fisica. B/Il Nuovo cimento B

A classical stochastic description of the quantum lattice gas model

Manuel Gadella

Published Jun 1, 1981• 2 citations
Publisher
DOI
10.1007/bf02755095

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Based on exact diagonalization data for finite quantum Heisenberg antiferromagnets on two frustrated lattices (two-leg ladder and bilayer) and analytical arguments we map low-energy degrees of freedom of the spin models in a magnetic field on classical lattice-gas models. Further we use transfer-matrix calculations and classical Monte Carlo simulations to give a quantitative description of low-temperature thermodynamics of the quantum spin models. The classical lattice-gas model yields an excellent description of the quantum spin models up to quite large temperatures. The main peculiarity of the considered frustrated bilayer is a phase transition which occurs at low temperatures for a wide range of magnetic fields below the saturation magnetic field and belongs to the two-dimensional Ising model universality class.
The work in this thesis is split into two main parts; the dynamical study of the fully packed classical dimer model, and the development of advanced large deviation techniques applied to the classical dimer model, highlighting the connection to the quantum dimer model. The classical dimer model on the square lattice is a paradigmatic example of a system subject to strong local constraints. We study its behavior under local stochastic dynamics, by means of Monte Carlo simulations and theoretical arguments. We observe clear signatures of correlated dynamics in both global and local observables and over a broad range of time scales, indicating a breakdown of the simple continuum description that approximates well the statics. We show that this collective dynamics can be understood in terms of one-dimensional “strings” of high mobility. We introduce a coarse-grained description of the strings, which leads to exact results in the limit of low string density and provides a detailed qualitative understanding of the dynamics in all flux sectors. We then go on, still using the fully packed dimers on the square lattice as a paradigmatic system, to study the connection between the phase behaviour of the ground state of quantum dimers and the dynamics of classical stochastic dimers. At the so-called Rokhsar-Kivelson (RK) point, a quantum dimer Hamiltonian is equivalent to the Markov generator of the dynamics of classical dimers. A less well understood fact is that away from the RK point the quantum-classical connection persists: in this case the quantum Hamiltonian maps to a non-stochastic "tilted" master operator of the classical stochastic problem. This implies a direct relation between the phase behaviour of quantum dimers and properties of ensembles of stochastic trajectories of classical dimers. Using transition path sampling (TPS) -- supplemented by trajectory umbrella sampling -- we obtain the large deviation statistics of dynamical activity in the classical problem, and show the correspondence between the phase behaviour of the classical and quantum systems. Finally, we take these ideas further by developing a feedback-based modified dynamics used for umbrella sampling alongside TPS. This feedback approach was first used in the cloning (or population dynamics) method. We compare different modified dynamics within TPS and show how much more efficient the feedback-modified dynamics can be than the original dynamics, for the purpose of rare event sampling. We also discuss how our approach may generalise to other problems with slow complex dynamics.
We consider the S = 1 / 2 antiferromagnetic Heisenberg model on a frustrated kagome-lattice bilayer with strong nearest-neighbor interlayer coupling and examine its low-temperature magnetothermodynamics using a mapping onto a rhombi gas on the kagome lattice. Besides, we use finite-size numerics to illustrate the validity of the classical lattice-gas description. Among our findings there are (i) the absence of an order-disorder phase transition and (ii) the sensitivity of the specific heat at low temperatures to the shape of the system just below the saturation magnetic field even in the thermodynamic limit.