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We have developed Aitomia - a platform powered by AI to assist in performing AI-driven atomistic and quantum chemical (QC) simulations. This evolving intelligent assistant platform is equipped with chatbots and AI agents to help experts and…

计算物理 · 物理学 2026-03-17 Jinming Hu , Hassan Nawaz , Yi-Fan Hou , Yuting Rui , Lijie Chi , Yuxinxin Chen , Arif Ullah , Pavlo O. Dral

Efforts to enhance education and broaden participation in AI will benefit from a systematic understanding of the competencies underlying AI expertise. In this paper, we observe that AI expertise requires integrating computational,…

计算机与社会 · 计算机科学 2022-10-03 Maithilee Kunda

Technological advances in the context of digital transformation are the basis for rapid developments in the field of artificial intelligence (AI). Although AI is not a new topic in computer science (CS), recent developments are having an…

计算机与社会 · 计算机科学 2023-05-12 Tilman Michaeli , Stefan Seegerer , Ralf Romeike

We explore the effectiveness and reliability of an artificial intelligence (AI)-based grading system for a handwritten general chemistry exam, comparing AI-assigned scores to human grading across various types of questions. Exam pages and…

计算机与社会 · 计算机科学 2025-11-11 Jan Cvengros , Gerd Kortemeyer

Generative AI challenges traditional assessments by allowing students to produce correct answers without demonstrating understanding or reasoning. Rather than prohibiting AI, this work argues that one way to integrate AI into education is…

计算机与社会 · 计算机科学 2026-02-03 Ahmad Samer Wazan

Quantum computing is increasingly practiced through programming, yet most educational offerings emphasize algorithmic or framework-level use rather than software engineering concerns such as testing, abstraction, tooling, and lifecycle…

软件工程 · 计算机科学 2026-04-28 Andriy Miranskyy

Natural language processing models have emerged that can generate usable software and automate a number of programming tasks with high fidelity. These tools have yet to have an impact on the chemistry community. Yet, our initial testing…

统计力学 · 物理学 2023-01-11 Glen M. Hocky , Andrew D. White

Research on how the popularization of generative Artificial Intelligence (AI) tools impacts learning environments has led to hesitancy among educators to teach these tools in classrooms, creating two observed disconnects. Generative AI…

计算机与社会 · 计算机科学 2025-11-18 Anya Bardach , Hamilton Murrah

In the pursuit of novel catalyst development to address pressing environmental concerns and energy demand, conventional design and optimization methods often fall short due to the complexity and vastness of the catalyst parameter space. The…

化学物理 · 物理学 2024-02-08 Nung Siong Lai , Yi Shen Tew , Xialin Zhong , Jun Yin , Jiali Li , Binhang Yan , Xiaonan Wang

The integration of AI tools into programming education has become increasingly prevalent in recent years, transforming the way programming is taught and learned. This paper provides a review of the state-of-the-art AI tools available for…

计算机与社会 · 计算机科学 2025-08-19 Nikolaos Avouris , Kyriakos Sgarbas , George Caridakis , Christos Sintoris

Artificial Intelligence (AI) education is an increasingly popular topic area for K-12 teachers. However, little research has investigated how AI education can be designed to be more accessible to all learners. We organized co-design…

物理教育 · 物理学 2020-09-24 Jessica Van Brummelen , Phoebe Lin

Artificial Intelligence (AI) has the potential to fundamentally change the educational landscape. So far, much of the physics education research relating to AI has focused on lecture-based assessment and the ability of ChatGPT to answer…

物理教育 · 物理学 2024-01-02 Andrew Low , Z. Yasemin Kalender

Despite growing interest in AI education, most AIED initiatives remain narrowly targeted toward STEM-prepared students, limiting participation by non-STEM learners and adults seeking to engage with AI in public-interest, policy, or…

计算机与社会 · 计算机科学 2026-04-24 Valentina Kuskova , Dmitry Zaytsev , Richard Johnson

Despite AI tools becoming increasingly embedded in academic practice, little is known about how university students integrate them into their writing processes. We examine how students engage with AI across different writing tasks, and how…

人机交互 · 计算机科学 2026-04-29 Silvia Bodei , Duncan P. Brumby , Katie Fisher , Jon Mella

As artificial intelligence (AI) increasingly shapes decision-making across domains, there is a growing need to support AI literacy among learners beyond computer science. However, many current approaches rely on programming-heavy tools or…

计算机与社会 · 计算机科学 2025-11-10 Aparna Maya Warrier , Arav Agarwal , Jaromir Savelka , Christopher Bogart , Heather Burte

Most AI literacy courses for non-technical undergraduates emphasize conceptual breadth over technical depth. This paper describes UNIV 182, a prerequisite-free course at George Mason University that teaches undergraduates across majors to…

计算机与社会 · 计算机科学 2026-04-14 Amarda Shehu

In response to the exponential growth in the use of artificial intelligence and machine learning applications, educators, researchers and policymakers have taken steps to integrate artificial intelligence applications into K-12 education.…

计算机与社会 · 计算机科学 2026-02-20 Yasmin Kafai , José Ramón Lizárraga , R. Benjamin Shapiro

Large language models (LLMs) are transforming the landscape of chemistry and materials science. Recent examples of LLM-accelerated experimental research include virtual assistants for parsing synthesis recipes from the literature, or using…

材料科学 · 物理学 2024-11-12 Davi M Fébba , Kingsley Egbo , William A. Callahan , Andriy Zakutayev

The recent emergence of generative AI and Large Language Models (LLMs), particularly following the release of ChatGPT in late 2022, has significantly impacted both academic research and industrial practice. This development has vast…

计算机与社会 · 计算机科学 2026-04-21 Iris Groher , Michael Vierhauser , Markus Weninger

The rapid adoption of generative artificial intelligence (AI) tools in higher education is transforming how students engage with undergraduate mathematics, raising concerns about learning and assessment validity. This study examines the…

历史与综述 · 数学 2025-12-25 Siyuan Wang , Qing Xia , Qiong Ye