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Quantum Hamiltonian simulation, fundamental in quantum algorithm design, extends far beyond its foundational roots, powering diverse quantum computing applications. However, optimizing the compilation of quantum Hamiltonian simulation poses significant challenges. Existing approaches fall short in reconciling deterministic and randomized compilation, lack appropriate intermediate representations, and struggle to guarantee correctness. Addressing these challenges, we present MarQSim, a novel compilation framework. MarQSim leverages a Markov chain-based approach, encapsulated in the Hamiltonian Term Transition Graph, adeptly reconciling deterministic and randomized compilation benefits. Furthermore, we formulate a Minimum-Cost Flow model that can tune transition matrices to enforce correctness while accommodating various optimization objectives. Experimental results demonstrate MarQSim's superiority in generating more efficient quantum circuits for simulating various quantum Hamiltonians while maintaining precision. 

In this paper, we propose novel Gaussian process-gated hierarchical mixtures of experts (GPHMEs). Unlike other mixtures of experts with gating models linear in the input, our model employs gating functions built with Gaussian processes (GPs). These processes are based on random features that are non-linear functions of the inputs. Furthermore, the experts in our model are also constructed with GPs. The optimization of the GPHMEs is performed by variational inference. The proposed GPHMEs have several advantages. They outperform tree-based HME benchmarks that partition the data in the input space, and they achieve good performance with reduced complexity. Another advantage is the interpretability they provide for deep GPs, and more generally, for deep Bayesian neural networks. Our GPHMEs demonstrate excellent performance for large-scale data sets, even with quite modest sizes.