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Large language models (LLMs) serve as an active and promising field of generative artificial intelligence and have demonstrated abilities to perform complex tasks in multiple domains, including mathematical and scientific reasoning. In this…

Artificial Intelligence · Computer Science 2026-03-03 Ao Cheng , Lei Zhang , Guowei He

Software testing plays a critical role in ensuring that systems behave as intended. However, existing automated testing approaches struggle to match the capabilities of human engineers due to key limitations such as test locality, lack of…

Software Engineering · Computer Science 2025-06-16 Kangping Xu , Yifan Luo , Yang Yuan , Andrew Chi-Chih Yao

Quantum computers hold the potential to surpass classical computers in solving complex computational problems. However, the fragility of quantum information and the error-prone nature of quantum operations make building large-scale,…

AI agents are increasingly used to solve complex, multi-step tasks, but existing multi-agent frameworks remain brittle as workflows grow in scale and depth. Small errors at intermediate stages can propagate through agent interactions, while…

Artificial Intelligence · Computer Science 2026-05-26 Andy Xu , Yu-Wing Tai

Large language models (LLMs) can generate code rapidly but remain unreliable for scientific algorithms whose correctness depends on structural assumptions rarely explicit in the source literature. We introduce a multi-stage LLM-assisted…

Computational Physics · Physics 2026-04-13 Yi Zhou

Automated code vulnerability detection is critical for software security, yet existing approaches face a fundamental trade-off between detection accuracy and computational cost. We propose a heterogeneous multi-agent architecture inspired…

Cryptography and Security · Computer Science 2026-04-24 Zhaohui Geoffrey Wang

Fault-tolerant logical entangling gates are essential for scalable quantum computing, but are limited by the error rates and overheads of physical two-qubit gates and measurements. To address this limitation, we introduce phantom…

As Large Language Models (LLMs) evolve into persistent scientific collaborators, context window saturation has emerged as a critical bottleneck. Scientific workflows involving iterative data analysis and hypothesis refinement rapidly…

Artificial Intelligence · Computer Science 2026-05-19 Nikola Milosevic

LLM-based coding agents can localize bugs, generate patches, and run tests with diminishing human oversight, yet the scaffolding code that surrounds the language model (the control loop, tool definitions, state management, and context…

Software Engineering · Computer Science 2026-04-14 Benjamin Rombaut

Despite long-standing efforts in accelerating scientific discovery with AI, building AI co-scientists remains challenging due to limited high-quality data for training and evaluation. To tackle this data scarcity issue, we present AutoSDT,…

Formal theorem proving (FTP) has emerged as a critical foundation for evaluating the reasoning capabilities of large language models, enabling automated verification of mathematical proofs at scale. However, progress has been constrained by…

Logic in Computer Science · Computer Science 2026-05-19 Terry Jingchen Zhang , Wenyuan Jiang , Rongchuan Liu , Yisong Wang , Junran Yang , Ning Wang , Nicole Ni , Yinya Huang , Mrinmaya Sachan

Ensuring reliable data-driven decisions is crucial in domains where analytical accuracy directly impacts safety, compliance, or operational outcomes. Decision support in such domains relies on large tabular datasets, where manual analysis…

Software Engineering · Computer Science 2026-03-11 Arsham Gholamzadeh Khoee , Shuai Wang , Robert Feldt , Dhasarathy Parthasarathy , Yinan Yu

In the rapidly evolving field of Electronic Design Automation (EDA), the deployment of Large Language Models (LLMs) for Register-Transfer Level (RTL) design has emerged as a promising direction. However, silicon-grade correctness remains…

Hardware Architecture · Computer Science 2026-01-28 Jiale Liu , Taiyu Zhou , Tianqi Jiang

The challenge of quantum computing is to combine error resilience with universal computation. Diagonal gates such as the transversal $T$ gate play an important role in implementing a universal set of quantum operations. This paper…

Quantum Physics · Physics 2022-09-14 Jingzhen Hu , Qingzhong Liang , Robert Calderbank

Large Language Models (LLMs) demonstrate potentials for automating scientific code generation but face challenges in reliability, error propagation in multi-agent workflows, and evaluation in domains with ill-defined success metrics. We…

Artificial Intelligence · Computer Science 2026-03-04 Zihang Zeng , Jiaquan Zhang , Pengze Li , Yuan Qi , Xi Chen

In the ongoing race towards experimental implementations of quantum error correction (QEC), finding ways to automatically discover codes and encoding strategies tailored to the qubit hardware platform is emerging as a critical problem.…

Quantum Physics · Physics 2025-11-14 Jan Olle , Remmy Zen , Matteo Puviani , Florian Marquardt

Generating accurate circuit schematics from high-level natural language descriptions remains a persistent challenge in electronic design automation (EDA), as large language models (LLMs) frequently hallucinate components, violate strict…

Artificial Intelligence · Computer Science 2026-05-28 Khandakar Shakib Al Hasan , Syed Rifat Raiyan , Hasin Mahtab Alvee , Wahid Sadik

Large language models have become proficient at generating functional code, but ensuring the output truly matches the programmer's intent remains difficult. Testing improves trust, yet for safety-critical applications, formal verification…

Software Engineering · Computer Science 2026-02-03 Mantas Baksys , Stefan Zetzsche , Olivier Bouissou , Remi Delmas , Soonho Kong , Sean B. Holden

Deep Research Agents (DRAs) aim to answer complex questions by searching the web, checking evidence, and synthesizing conclusions across heterogeneous sources. We introduce a category-theoretic framework for evaluating and improving such…

Machine Learning · Computer Science 2026-04-30 Shuoling Liu , Zhiquan Tan , Kun Yi , Hui Wu , Yihan Li , Jiangpeng Yan , Liyuan Chen , Kai Chen , Qiang Yang

The automation of chemical research through self-driving laboratories (SDLs) promises to accelerate scientific discovery, yet the reliability and granular performance of the underlying AI agents remain critical, under-examined challenges.…

Artificial Intelligence · Computer Science 2025-10-01 Gihan Panapitiya , Emily Saldanha , Heather Job , Olivia Hess