Ground state projection of quantum spin systems in the valence bond basis

Abstract

A Monte Carlo method for quantum spin systems is formulated in the basis of valence bond (singlet pair) states. The non-orthogonality of this basis allows for an efficient importance-sampled projection of the ground state out of an arbitrary state. The method provides access to resonating valence-bond physics, enables a direct improved estimator for the singlet-triplet gap, and extends the class of models that can be studied without negative-sign problems. As a demonstration, the valence bond distribution in the ground state of the 2D Heisenberg antiferromagnet is calculated. Generalizations of the method to fermion systems are also discussed.