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arXiv · 2310.19032

Improvements to the Stochastic Series Expansion method for the $JQ_2$ model with a magnetic field

Lu Liu
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Abstract

The Stochastic Series Expansion (SSE) quantum Monte Carlo method with directed loops is very efficient for spin and boson systems. The Heisenberg mode l and its generalizations, such as the $JQ_2$ model, are extensively simulated via this method. When introducing magnetic field in these models, the SSE method always combines the field with the diagonal part of the Heisenberg interactions (${S_i}^z{S_j}^z$) and take them as the new diagonal operators. In general, this treatment is reasonable. However, when studying Hamiltonians which have other interactions or even don't contain the Heisenberg interactio ns, this general treatment will not be efficient or even not work. We suggest that when doing directed-loop simulations, the magnetic field can be put in to other interactions. This new treatment, in some cases, improves the simulation efficiency. Using the $JQ_2$ model with magnetic field as an example, w e here demonstrate this new SSE method. Such new treatment significantly improves the efficiency when the $Q_2$ interactions are large. The autocorrelati ons are reduced a lot compared to the previous approach. In addition, we argue that we can divide the magnetic field into two parts and combine them with both the $J$ and $Q$ operators respectively. This treatment also improves the simulation efficiency. The underlying mechanism is that these two new SSE methods can utilize the main part or even all part of operators in operator products to do the directe d-loop updates. Such idea can also be applied to other models with magnetic field and it will speed up the simulations.

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Lu Liu. 2023-10-29. Improvements to the Stochastic Series Expansion method for the $JQ_2$ model with a magnetic field. https://doi.org/10.1103/physrevb.109.045141

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