The rise of physical quantum computer availability and accessibility to the public increases the interest of researchers in various domains. In order to operate the quantum computer, users have to construct their quantum circuit based on each machine manufacturer development kit. Most of these development kits are developed for Python in favor of accessibility and a user-friendly environment. However, the quantum application is not just a quantum circuit execution. It needs the preparation phase and also the output interpreter phase. Each phase may require different computing resources to work efficiently. We developed a Python-based workflow system to assist users in executing their quantum applications within a rich and diverse computing environment, such as large-scale HPC systems. Our workflow system provides interoperability across heterogeneous platforms by introducing an abstraction layer for job submission, allowing both quantum and HPC workloads to be submitted seamlessly to systems with different job-submission interfaces. This workflow system can divide the application into smaller tasks and allow each task to pair with the suitable computing resources. We conducted the experiments by applying this workflow system with Quantum Phase Estimation, Sample-based Quantum Diagonalization, and Post-Variational Quantum Neural Networks. The results of the experiments demonstrate that each divided task from both applications can be executed on different computing resources efficiently.
The rise of physical quantum computer availability and accessibility to the public increases the interest of researchers in various domains. In order to operate the quantum computer, users have to construct their quantum circuit based on each machine manufacturer development kit. Most of these development kits are developed for Python in favor of accessibility and a user-friendly environment. However, the quantum application is not just a quantum circuit execution. It needs the preparation phase and also the output interpreter phase. Each phase may require different computing resources to work efficiently. We developed a Python-based workflow system to assist users in executing their quantum applications within a rich and diverse computing environment, such as large-scale HPC systems. Our workflow system provides interoperability across heterogeneous platforms by introducing an abstraction layer for job submission, allowing both quantum and HPC workloads to be submitted seamlessly to systems with different job-submission interfaces. This workflow system can divide the application into smaller tasks and allow each task to pair with the suitable computing resources. We conducted the experiments by applying this workflow system with Quantum Phase Estimation, Sample-based Quantum Diagonalization, and Post-Variational Quantum Neural Networks. The results of the experiments demonstrate that each divided task from both applications can be executed on different computing resources efficiently.
Hybrid quantum-high performance computing (Q-HPC) workflows are emerging as a key strategy for running quantum applications at scale in current noisy intermediate-scale quantum (NISQ) devices. These workflows must operate seamlessly across diverse simulators and hardware backends since no single simulator offers the best performance for every circuit type. Simulation efficiency depends strongly on circuit structure, entanglement, and depth, making a flexible and backend-agnostic execution model essential for fair benchmarking, informed platform selection, and ultimately the identification of quantum advantage opportunities. In this work, we extend the Quantum Framework (QFw), a modular and HPC-aware orchestration layer, to integrate multiple local backends (Qiskit Aer, NWQ-Sim, QTensor, and TN-QVM) and a cloud-based quantum backend (IonQ) under a unified interface. Using this integration, we execute a number of non-variational as well as variational workloads. The results highlight workload-specific backend advantages: while Qiskit Aer’s matrix product state excels for large Ising models, NWQ-Sim not only leads on large-scale entanglement and Hamiltonian but also shows the benefits of concurrent subproblem execution in a distributed manner for optimization problems. These findings demonstrate that simulator-agnostic, HPC-aware orchestration is a practical path toward scalable, reproducible, and portable Q-HPC ecosystems, thereby accelerating progress toward demonstrating quantum advantage.
Hybrid quantum-classical applications pose significant resource management challenges due to heterogeneity and dynamism in both infrastructure and workloads. Quantum-HPC environments integrate quantum processing units (QPUs) with diverse classical resources (CPUs, GPUs), while applications span coupling patterns from tightly coupled execution to loosely coupled task parallelism with varying resource requirements. Traditional HPC schedulers lack visibility into application semantics and cannot respond to fluctuating resource availability at runtime. This paper presents a middleware-based approach for adaptive resource, workload, and task management in hybrid quantum-HPC systems. We make four contributions: (i) a conceptual four-layer middleware architecture that decomposes management across workflow, workload, task, and resource levels, enabling application-aware scheduling over heterogeneous quantum-HPC resources; (ii) a set of execution motifs capturing interaction and coupling characteristics of hybrid applications, realized as quantum mini-apps for systematic workload characterization; (iii) Pilot-Quantum, a middleware framework built on the pilot abstraction that enables late binding and dynamic resource allocation, adapting to resource and workload dynamics at runtime; and (iv) Q-Dreamer, a performance modeling toolkit providing reusable components for informed workload partitioning, including a circuit-cutting optimizer that analytically derives optimal partitioning strategies. Evaluation on heterogeneous HPC platforms (Perlmutter, NVIDIA DGX with H100/B200 GPUs) demonstrates efficient multi-backend orchestration across CPUs, GPUs, and QPUs for diverse execution motifs. Q-Dreamer predicts optimal circuit cutting configurations with up to 82% accuracy.
Quantum computers have demonstrated utility in simulating quantum systems beyond brute-force classical approaches. As the community builds on these demonstrations to explore using quantum computing for applied research, algorithms and workflows have emerged that require leveraging both quantum computers and classical high-performance computing (HPC) systems to scale applications, especially in chemistry and materials, beyond what either system can simulate alone. Today, these disparate systems operate in isolation, forcing users to manually orchestrate workloads, coordinate job scheduling, and transfer data between systems -- a cumbersome process that hinders productivity and severely limits rapid algorithmic exploration. These challenges motivate the need for flexible and high-performance Quantum-Centric Supercomputing (QCSC) systems that integrate Quantum Processing Units (QPUs), Graphics Processing Units (GPUs), and Central Processing Units (CPUs) to accelerate discovery of such algorithms across applications. These systems will be co-designed across quantum and classical HPC infrastructure, middleware, and application layers to accelerate the adoption of quantum computing for solving critical computational problems. We envision QCSC evolution through three distinct phases: (1) quantum systems as specialized compute offload engines within existing HPC complexes; (2) heterogeneous quantum and classical HPC systems coupled through advanced middleware, enabling seamless execution of hybrid quantum-classical algorithms; and (3) fully co-designed heterogeneous quantum-HPC systems for hybrid computational workflows. This article presents a reference architecture and roadmap for these QCSC systems.
High-performance computing (HPC) has evolved over decades through multiple architectural transitions, from vector supercomputers to massively parallel CPU clusters and GPU-accelerated systems, continuously expanding the frontier of scientific discovery. With the emergence of quantum processing units (QPUs) as practical computational accelerators, a new opportunity arises to further extend this trajectory by integrating quantum and classical computing paradigms. Building on the emerging vision of Quantum Integrated High-Performance Computing (QHPC), this paper contributes a full-stack layered architecture that integrates QPUs as first-class accelerators within, not merely alongside, the classical HPC software and hardware stack, with tight, on-premise quantum-classical coupling as its defining characteristic. The architecture comprises of unified resource management, quantum-aware scheduling, hybrid workflow orchestration, middleware and programming abstraction, interconnect technologies, and a tiered execution model enabling seamless workload partitioning across classical and quantum backends. A central aspect of this architecture is a strong user requests abstraction layer that exposes heterogeneous resources through a unified job submission interface, similar in spirit to existing schedulers such as Slurm, allowing users to describe workloads in a consistent template independent of underlying compute type or location. Drawing insights from prior accelerator integration eras, we outline how QHPC can support emerging workloads in quantum chemistry, materials discovery, combinatorial optimization, and climate modeling. We conclude by highlighting open challenges in building scalable, reliable, and programmable quantum-classical infrastructures that seamlessly connect global users to heterogeneous compute resources for future quantum-classical HPC ecosystems.
High-performance computing (HPC) has evolved over decades through multiple architectural transitions, from vector supercomputers to massively parallel CPU clusters and GPU-accelerated systems, continuously expanding the frontier of scientific discovery. With the emergence of quantum processing units (QPUs) as practical computational accelerators, a new opportunity arises to further extend this trajectory by integrating quantum and classical computing paradigms. Building on the emerging vision of Quantum Integrated High-Performance Computing (QHPC), this paper contributes a full-stack layered architecture that integrates QPUs as first-class accelerators within, not merely alongside, the classical HPC software and hardware stack, with tight, on-premise quantum–classical coupling as its defining characteristic. The architecture comprises of unified resource management, quantum-aware scheduling, hybrid workflow orchestration, middleware and programming abstraction, interconnect technologies, and a tiered execution model enabling seamless workload partitioning across classical and quantum backends. A central aspect of this architecture is a strong user requests abstraction layer that exposes heterogeneous resources through a unified job submission interface, similar in spirit to existing schedulers such as Slurm, allowing users to describe workloads in a consistent template independent of underlying compute type or location. Drawing insights from prior accelerator integration eras, we outline how QHPC can support emerging workloads in quantum chemistry, materials discovery, combinatorial optimization, and climate modeling. We conclude by highlighting open challenges in building scalable, reliable, and programmable quantum–classical infrastructures that seamlessly connect global users to heterogeneous compute resources for future quantum–classical HPC ecosystems.
As quantum hardware advances, integrating quantum processing units (QPUs) into HPC environments and managing diverse infrastructure and software stacks becomes increasingly essential. Pilot-Quantum addresses these challenges as a middleware designed to provide unified application-level management of resources and workloads across hybrid quantum-classical environments. It is built on a rigorous analysis of existing quantum middleware systems and application execution patterns. It implements the Pilot Abstraction conceptual model, originally developed for HPC, to manage resources, workloads, and tasks. It is designed for quantum applications that rely on task parallelism, including (i) hybrid algorithms, such as variational approaches, and (ii) circuit cutting systems, used to partition and execute large quantum circuits. Pilot-Quantum facilitates seamless integration of QPUs, classical CPUs, and GPUs, while supporting high-level programming frameworks like Qiskit and Pennylane. This enables users to efficiently design and execute hybrid workflows across diverse computing resources. The capabilities of Pilot-Quantum are demonstrated through mini-apps -- simplified yet representative kernels focusing on critical performance bottlenecks. We demonstrate the capabilities of Pilot-Quantum through multiple mini-apps, including different circuit executions (e.g., using IBMś Eagle QPU and simulators), circuit cutting, and quantum machine learning scenarios.