activity
20232025
most citedAgent-based Learning of Materials Datasets from Scientific Literature

12 citations · 27 across the 5 of their papers we have counts for

collaborators

5 papers

cs.LG2025★ 2 cited

34 Examples of LLM Applications in Materials Science and Chemistry: Towards Automation, Assistants, Agents, and Accelerated Scientific Discovery

Yoel Zimmermann, Adib Bazgir, Alexander Al-Feghali +32

Large Language Models (LLMs) are reshaping many aspects of materials science and chemistry research, enabling advances in molecular property prediction, materials design, scientifi…

cond-mat.mtrl-sci2025

Kernel Learning Assisted Synthesis Condition Exploration for Ternary Spinel

Yutong Liu, Mehrad Ansari, Robert Black +1

Machine learning and high-throughput experimentation have greatly accelerated the discovery of mixed metal oxide catalysts by leveraging their compositional flexibility. However, t…

cs.LG2024★ 5 cited

Reflections from the 2024 Large Language Model (LLM) Hackathon for Applications in Materials Science and Chemistry

Yoel Zimmermann, Adib Bazgir, Zartashia Afzal +141

Here, we present the outcomes from the second Large Language Model (LLM) Hackathon for Applications in Materials Science and Chemistry, which engaged participants across global hyb…

physics.chem-ph2024★ 8 cited

dZiner: Rational Inverse Design of Materials with AI Agents

Mehrad Ansari, Jeffrey Watchorn, Carla E. Brown +1

Recent breakthroughs in machine learning and artificial intelligence, fueled by scientific data, are revolutionizing the discovery of new materials. Despite the wealth of existing…

cs.AI2023★ 12 cited

Agent-based Learning of Materials Datasets from Scientific Literature

Mehrad Ansari, Seyed Mohamad Moosavi

Advancements in machine learning and artificial intelligence are transforming materials discovery. Yet, the availability of structured experimental data remains a bottleneck. The v…