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This paper explores artificial intelligence (AI) methods for the approximate compiling of unitaries, focusing on the use of fixed two-qubit gates and arbitrary single-qubit rotations typical in superconducting hardware. Our approach involves three main stages: identifying an initial template that approximates the target unitary, predicting initial parameters for this template, and refining these parameters to maximize the fidelity of the circuit. We propose AI-driven approaches for the first two stages, with a deep learning model that suggests initial templates and an autoencoder-like model that suggests parameter values, which are refined through gradient descent to achieve the desired fidelity. We demonstrate the method on 2 and 3-qubit unitaries, showcasing promising improvements over exhaustive search and random parameter initialization. The results highlight the potential of AI to enhance the transpiling process, supporting more efficient quantum computations on current and future quantum hardware.

Quantum programs are typically developed using quantum Software Development Kits (SDKs). The rapid advancement of quantum computing necessitates new tools to streamline this development process, and one such tool could be Generative Artificial intelligence (GenAI). In this study, we introduce and use the Qiskit HumanEval dataset, a hand-curated collection of tasks designed to benchmark the ability of Large Language Models (LLMs) to produce quantum code using Qiskit - a quantum SDK. This dataset consists of more than 100 quantum computing tasks, each accompanied by a prompt, a canonical solution, a comprehensive test case, and a difficulty scale to evaluate the correctness of the generated solutions. We systematically assess the performance of a set of LLMs against the Qiskit HumanEval dataset's tasks and focus on the models ability in producing executable quantum code. Our findings not only demonstrate the feasibility of using LLMs for generating quantum code but also establish a new benchmark for ongoing advancements in the field and encourage further exploration and development of GenAI-driven tools for quantum code generation.

Code Large Language Models (Code LLMs) have emerged as powerful tools, revolutionizing the software development landscape by automating the coding process and reducing time and effort required to build applications. This paper focuses on training Code LLMs to specialize in the field of quantum computing. We begin by discussing the unique needs of quantum computing programming, which differ significantly from classical programming approaches or languages. A Code LLM specializing in quantum computing requires a foundational understanding of quantum computing and quantum information theory. However, the scarcity of available quantum code examples and the rapidly evolving field, which necessitates continuous dataset updates, present significant challenges. Moreover, we discuss our work on training Code LLMs to produce high-quality quantum code using the Qiskit library. This work includes an examination of the various aspects of the LLMs used for training and the specific training conditions, as well as the results obtained with our current models. To evaluate our models, we have developed a custom benchmark, similar to HumanEval, which includes a set of tests specifically designed for the field of quantum computing programming using Qiskit. Our findings indicate that our model outperforms existing state-of-the-art models in quantum computing tasks. We also provide examples of code suggestions, comparing our model to other relevant code LLMs. Finally, we introduce a discussion on the potential benefits of Code LLMs for quantum computing computational scientists, researchers, and practitioners. We also explore various features and future work that could be relevant in this context.

This paper demonstrates the integration of Reinforcement Learning (RL) into quantum transpiling workflows, significantly enhancing the synthesis and routing of quantum circuits. By employing RL, we achieve near-optimal synthesis of Linear Function, Clifford, and Permutation circuits, up to 9, 11 and 65 qubits respectively, while being compatible with native device instruction sets and connectivity constraints, and orders of magnitude faster than optimization methods such as SAT solvers. We also achieve significant reductions in two-qubit gate depth and count for circuit routing up to 133 qubits with respect to other routing heuristics such as SABRE. We find the method to be efficient enough to be useful in practice in typical quantum transpiling pipelines. Our results set the stage for further AI-powered enhancements of quantum computing workflows.

Computational models are an essential tool for the design, characterization, and discovery of novel materials. Hard computational tasks in materials science stretch the limits of existing high-performance supercomputing centers, consuming much of their simulation, analysis, and data resources. Quantum computing, on the other hand, is an emerging technology with the potential to accelerate many of the computational tasks needed for materials science. In order to do that, the quantum technology must interact with conventional high-performance computing in several ways: approximate results validation, identification of hard problems, and synergies in quantum-centric supercomputing. In this paper, we provide a perspective on how quantum-centric supercomputing can help address critical computational problems in materials science, the challenges to face in order to solve representative use cases, and new suggested directions., Comment: 65 pages, 15 figures; comments welcome

Defining the right metrics to properly represent the performance of a quantum computer is critical to both users and developers of a computing system. In this white paper, we identify three key attributes for quantum computing performance: quality, speed, and scale. Quality and scale are measured by quantum volume and number of qubits, respectively. We propose a speed benchmark, using an update to the quantum volume experiments that allows the measurement of Circuit Layer Operations Per Second (CLOPS) and identify how both classical and quantum components play a role in improving performance. We prescribe a procedure for measuring CLOPS and use it to characterize the performance of some IBM Quantum systems., Comment: Early draft of a proposed speed benchmark. Feedback requested

In recent years, the use of deep learning in language models gained much attention. Some research projects claim that they can generate text that can be interpreted as human-writing, enabling new possibilities in many application areas. Among the different areas related to language processing, one of the most notable in applying this type of modeling is programming languages. For years, the Machine Learning community has been researching this software engineering area, pursuing goals like applying different approaches to auto-complete, generate, fix, or evaluate code programmed by humans. Considering the increasing popularity of the Deep-Learning-enabled language models approach, we detected a lack of empirical papers that compare different deep learning architectures to create and use language models based on programming code. This paper compares different neural network architectures like AWD-LSTMs, AWD-QRNNs, and Transformer while using transfer learning and different tokenizations to see how they behave in building language models using a Python dataset for code generation and filling mask tasks. Considering the results, we discuss each approach's different strengths and weaknesses and what gaps we find to evaluate the language models or apply them in a real programming context.