Incorporating Quantum Computers into High Performance Computing (HPC) environments (commonly referred to as HPC+QC integration) marks a pivotal step in advancing computational capabilities for scientific research. Here we report the integration of a superconducting 20-qubit quantum computer into the HPC infrastructure at Leibniz Supercomputing Centre (LRZ), one of the first practical implementations of its kind. This yielded four key lessons: (1) quantum computers have stricter facility requirements than classical systems, yet their deployment in HPC environments is feasible when preceded by a rigorous site survey to ensure compliance; (2) quantum computers are inherently dynamic systems that require regular recalibration that is automatic and controllable by the HPC scheduler; (3) redundant power and cooling infrastructure is essential; and (4) effective hands-on onboarding should be provided for both quantum experts and new users. The identified conclusions provide a roadmap to guide future HPC center integrations.
Incorporating Quantum Computers into High Performance Computing (HPC) environments (commonly referred to as HPC+QC integration) marks a pivotal step in advancing computational capabilities for scientific research. Here we report the integration of a superconducting 20-qubit quantum computer into the HPC infrastructure at Leibniz Supercomputing Centre (LRZ), one of the first practical implementations of its kind. This yielded four key lessons: (1) quantum computers have stricter facility requirements than classical systems, yet their deployment in HPC environments is feasible when preceded by a rigorous site survey to ensure compliance; (2) quantum computers are inherently dynamic systems that require regular recalibration that is automatic and controllable by the HPC scheduler; (3) redundant power and cooling infrastructure is essential; and (4) effective hands-on onboarding should be provided for both quantum experts and new users. The identified conclusions provide a roadmap to guide future HPC center integrations.
The computational requirements of applications running in supercomputing centres are growing rapidly and diversifying over time. To meet these needs, developers are constantly developing new processors, domain-specific accelerators, and technologies. Quantum computing is one notable technology that has the potential to speed up certain computations and could be used to enhance High Performance Computing (HPC). However, integrating a quantum computer (QC) into HPC systems is a complex and challenging task, both at the physical and software level. Although various types of accelerators have been integrated into HPC in the past, the integration of QC into HPC presents a unique challenge as it operates on a new computing paradigm and is a scarce resource that needs to be shared among multiple jobs. Furthermore, HPCQC integration is a multidisciplinary field and integration can mean different things to different stakeholders. Our approach to HPCQC integration is from the perspective of an HPC centre where QC is integrated into the HPC environment as an accelerator. We identify parameters that are important for the integration, including network latency, HPCQC hybrid application characteristics and fine-grained scheduling. In addition, we develop a custom simulation model that can comprehensively simulate a hybrid classical-quantum compute system at selected level of detail. This simulation model is utilised to simulate the performance of a hybrid application by adjusting its features on a hybrid system with varying parameters. We discover that fine-grained scheduling is critical to performance, and network latency between QC and HPC has a significant impact on hybrid system performance.
Quantum computing promises unprecedented possibilities for important computing tasks such as quantum simulations in chemistry and materials science or optimization and machine learning. With this potential, quantum computing is increasingly attracting interest from industry and scientific communities that use high performance computing (HPC) for their applications.Practical application requires the integration of quantum computers into existing HPC infrastructures in the form of quantum-classical hybrid computing models.The Jülich UNified Infrastructure for Quantum computing (JUNIQ), a manufacturer-independent quantum computing user facility established at the Jülich Supercomputing Centre (JSC) aims to address these needs.As an example, we present benchmarking results for the quantum approximate optimization algorithm (QAOA) emulated on a supercomputer and for the D-Wave quantum annealers for the tail assignment problem, a planning problem from aircraft industry.
As computational demands in scientific applications continue to rise, hybrid high-performance computing (HPC) systems integrating classical and quantum computers (HPC-QC) are emerging as a promising approach to tackling complex computational challenges. One critical area of application is Hamiltonian simulation, a fundamental task in quantum physics and other large-scale scientific domains. This paper investigates strategies for quantum-classical integration to enhance Hamiltonian simulation within hybrid supercomputing environments. By analyzing computational primitives in HPC allocations dedicated to these tasks, we identify key components in Hamiltonian simulation workflows that stand to benefit from quantum acceleration. To this end, we systematically break down the Hamiltonian simulation process into discrete computational phases, highlighting specific primitives that could be effectively offloaded to quantum processors for improved efficiency. Our empirical findings provide insights into system integration, potential offloading techniques, and the challenges of achieving seamless quantum-classical interoperability. We assess the feasibility of quantum-ready primitives within HPC workflows and discuss key barriers such as synchronization, data transfer latency, and algorithmic adaptability. These results contribute to the ongoing development of optimized hybrid solutions, advancing the role of quantum-enhanced computing in scientific research.
Scientific applications are starting to explore the viability of quantum computing. This exploration typically begins with quantum simulations that can run on existing classical platforms, albeit without the performance advantages of real quantum resources. In the context of high-performance computing (HPC), the incorporation of simulation software can often take advantage of the powerful resources to help scale-up the simulation size. The configuration, installation and operation of these quantum simulation packages on HPC resources can often be rather daunting and increases friction for experimentation by scientific application developers. We describe a framework to help streamline access to quantum simulation software running on HPC resources. This includes an interface for circuit-based quantum computing tasks, as well as the necessary resource management infrastructure to make effective use of the underlying HPC resources. The primary contributions of this work include a classification of different usage models for quantum simulation in an HPC context, a review of the software architecture for our approach and a detailed description of the prototype implementation to experiment with these ideas using two different simulators (TNQVM & NWQ-Sim). We include initial experimental results running on the Frontier supercomputer at the Oak Ridge Leadership Computing Facility (OLCF) using a synthetic workload generated via the SupermarQ quantum benchmarking framework.
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.
Quantum computing (QC) introduces a novel mode of computation with the possibility of greater computational power that remains to be exploitedpresenting exciting opportunities for high-performance computing (HPC) applications. However, recent advancements in the field have made clear that QC does not supplant conventional HPC, but can rather be incorporated into current heterogeneous HPC infrastructures as an additional accelerator, thereby enabling the optimal utilization of both paradigms. The desire for such integration significantly affects the development of software for quantum computers, which in turn influences the necessary software infrastructure. To date, previous review articles have investigated various quantum programming tools (QPTs) (such as languages, libraries, frameworks) in their ability to program, compile, and execute quantum circuits. However, the integration effort with classical HPC frameworks or systems has not been addressed. This study aims to characterize existing QPTs from an HPC perspective, investigating if existing QPTs have the potential to be efficiently integrated with classical computing models and determining where work is still required. This work structures a set of criteria into an analysis blueprint that enables HPC scientists to assess whether a QPT is suitable for a high-performance computing quantum computing (HPCQC) environment.