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Zongkang Zhang

Publications and source records attributed to Zongkang Zhang.

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Low-cost algorithm-to-execution framework for surface-code quantum computing

The execution of useful quantum algorithms on fault-tolerant processors requires more than a mapping from logical gates to encoded operations: the spatial organization, non-Clifford resource supply, and execution schedule must also be determined while keeping physical overhead within practical limits. Although the theoretical hierarchy from logical circuits to fault-tolerant operations is well established, these implementation choices are often specified and optimized separately. Here we develop a low-cost algorithm-to-execution framework for surface-code quantum computing. From hierarchical algorithm descriptions, it constructs dependency-preserving logical schedules and an executable workload capturing logical interactions, operation parallelism, and time-resolved non-Clifford demand, thereby linking logical computation to surface-code organization, resource-state preparation, and fault-tolerant execution in a traceable workflow. We apply the framework to twenty benchmark circuits across seven algorithm families and a hierarchically composed application-scale elliptic-curve discrete-logarithm workload. Physical costs vary substantially even for circuits with similar logical resource counts. Under our direct-rotation calibration, non-Clifford implementation selection reduces space-time volume by up to 241.5 times versus an all-synthesis baseline for the QAOA amplitude-amplification workload. Circuit-specific surface-code layouts reduce routed-latency estimates for all twenty benchmarks; thirteen also reduce space-time volume because communication savings outweigh added spatial overhead. These results show that low-cost fault-tolerant execution depends on computation scheduling and organization, not aggregate logical resource counts alone.

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Transformer refined quantum sampling for strongly correlated electronic structure

Although quantum computing offers a promising solution for strongly correlated system simulation, existing algorithms face significant bottlenecks on current noisy intermediate-scale quantum (NISQ) devices. Here, we introduce QiankunNet-QSCI, a hybrid quantum-classical framework that addresses this challenge by combining efficient quantum-sampling with a transformer neural network. An efficient unitary selected configuration Interaction (USCI) ansatz especially designed for quantum sampling is proposed to identify the most chemically significant electronic configurations on the Zuchongzhi 3.1 quantum processor. Subsequently, the transformer model QiankunNet learns from these sparse yet critical quantum data to infer and reconstruct the complete electronic wavefunction with high fidelity. Simulation of the challenging 40-qubit [2Fe-2S] ferredoxin active center achieves chemical accuracy. Simulation of the nitrogenase P-cluster in a 114-electron 73-orbital active space also reaches 12 milli-Hartree-level agreement with the best density matrix renormalization group (DMRG) result. QiankunNet-QSCI thus offers a practical route to accurate quantum-assisted electronic structure calculations on current devices.

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Super-bath Quantum Eigensolver

The simulation of the dynamics of a system coupled to a low-temperature environment is a promising application of quantum computers to determine ground-state properties of physical systems. However, this approach requires not only the $\textit{existence}$ of an environment that allows the system to dissipate energy and evolve to its ground state, but also the $\textit{detailed knowledge}$ of the properties of the bath. In this paper, we propose a polynomial-time algorithm for ground state preparation which only relies on the $\textit{existence}$ of a physical bath which achieves the same task, while a detailed description of the environment may remain $\textit{unknown}$. In particular, we show that this ``super-bath quantum eigensolver algorithm'' prepares the ground state of the system by combining a Gaussian stabilization dephasing procedure with the simulation of the interaction between the system and a super-bath which only requires minimal knowledge of the physical environment. Based on our algorithmic framework, we establish a partial order relation among environments. Supported by experimental lifetime data of nuclear metastable states, we suggest that our algorithm is applicable to determine nuclear ground states in polynomial time. These results highlight the potential advantage of quantum computing in addressing ground state problems in real-world physical systems.

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Quantum-enhanced neural networks for quantum many-body simulations

Neural quantum states (NQS) have gained prominence in variational quantum Monte Carlo methods in approximating ground-state wavefunctions. Despite their success, they face limitations in optimization, scalability, and expressivity in addressing certain problems. In this work, we propose a quantum-neural hybrid framework that combines parameterized quantum circuits with neural networks to model quantum many-body wavefunctions. This approach combines the efficient sampling and optimization capabilities of autoregressive neural networks with the enhanced expressivity provided by quantum circuits. Numerical simulations demonstrate the scalability and accuracy of the hybrid ansatz in spin systems and quantum chemistry problems. Our results reveal that the hybrid method achieves notably lower relative energy compared to standalone NQS. These findings underscore the potential of quantum-neural hybrid methods for tackling challenging problems in quantum many-body simulations.

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Measurement-efficient quantum Krylov subspace diagonalisation

The Krylov subspace methods, being one category of the most important classical numerical methods for linear algebra problems, can be much more powerful when generalised to quantum computing. However, quantum Krylov subspace algorithms are prone to errors due to inevitable statistical fluctuations in quantum measurements. To address this problem, we develop a general theoretical framework to analyse the statistical error and measurement cost. Based on the framework, we propose a quantum algorithm to construct the Hamiltonian-power Krylov subspace that can minimise the measurement cost. In our algorithm, the product of power and Gaussian functions of the Hamiltonian is expressed as an integral of the real-time evolution, such that it can be evaluated on a quantum computer. We compare our algorithm with other established quantum Krylov subspace algorithms in solving two prominent examples. To achieve an error comparable to that of the classical Lanczos algorithm at the same subspace dimension, our algorithm typically requires orders of magnitude fewer measurements than others. Such an improvement can be attributed to the reduced cost of composing projectors onto the ground state. These results show that our algorithm is exceptionally robust to statistical fluctuations and promising for practical applications.

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Maximising Quantum-Computing Expressive Power through Randomised Circuits

In the noisy intermediate-scale quantum era, variational quantum algorithms (VQAs) have emerged as a promising avenue to obtain quantum advantage. However, the success of VQAs depends on the expressive power of parameterised quantum circuits, which is constrained by the limited gate number and the presence of barren plateaus. In this work, we propose and numerically demonstrate a novel approach for VQAs, utilizing randomised quantum circuits to generate the variational wavefunction. We parameterize the distribution function of these random circuits using artificial neural networks and optimize it to find the solution. This random-circuit approach presents a trade-off between the expressive power of the variational wavefunction and time cost, in terms of the sampling cost of quantum circuits. Given a fixed gate number, we can systematically increase the expressive power by extending the quantum-computing time. With a sufficiently large permissible time cost, the variational wavefunction can approximate any quantum state with arbitrary accuracy. Furthermore, we establish explicit relationships between expressive power, time cost, and gate number for variational quantum eigensolvers. These results highlight the promising potential of the random-circuit approach in achieving a high expressive power in quantum computing.

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Quantum algorithms for optimal effective theory of many-body systems

A common situation in quantum many-body physics is that the underlying theories are known but too complicated to solve efficiently. In such cases one usually builds simpler effective theories as low-energy or large-scale alternatives to the original theories. Here the central tasks are finding the optimal effective theories and proving their equivalence to the original theories. Recently quantum computing has shown the potential of solving quantum many-body systems by exploiting its inherent parallelism. It is thus an interesting topic to discuss the emergence of effective theories and design efficient tools for finding them based on the results from quantum computing. As the first step towards this direction, in this paper, we propose two approaches that apply quantum computing to find the optimal effective theory of a quantum many-body system given its full Hamiltonian. The first algorithm searches the space of effective Hamiltonians by quantum phase estimation and amplitude amplification. The second algorithm is based on a variational approach that is promising for near-future applications.

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Quantum algorithms for Schrieffer-Wolff transformation

The Schrieffer-Wolff transformation aims to solve degenerate perturbation problems and give an effective Hamiltonian that describes the low-energy dynamics of the exact Hamiltonian in the low-energy subspace of unperturbed Hamiltonian. This unitary transformation decoupling the low-energy and high-energy subspaces for the transformed Hamiltonian can be realized by quantum circuits. We give a fully quantum algorithm for realizing the SW transformation. We also propose a hybrid quantum-classical algorithm for finding the effective Hamiltonian on NISQ hardware, where a general cost function is used to indicate the decoupling degree. Numerical simulations without or with noise and experiments on quantum computer ibmq_manila are implemented for a Heisenberg chain model. Our results verify the algorithm and show its validity on near-term quantum computers.

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