MIT News AI

Paving the way for greener ammonia production

New MIT research could lead to better materials for a fossil-fuel-free process for making the chemical that's essential to fertilizer and other products.

arXiv AI
Sep 10

The convergent laboratory: when AI reasoning, autonomous experiments, high performance and quantum computing reshape chemistry

The article titled "The convergent laboratory: when AI reasoning, autonomous experiments, high performance and quantum computing reshape chemistry" discusses insights from the TPC26 conference, where leaders from academia, national laboratories, and industry examined how AI, autonomous agents, self-driving labs, high‑performance computing, and quantum computing converge to accelerate materials science discovery. It presents firsthand experiences from researchers at the forefront of these technologies and argues that their simultaneous maturation marks a tipping point for transformative advances and productive disruption in chemical sciences.

By Eliu Huerta, Xiaoyun Wang, Geetika Gupta, Edward H. Sargent, Cameron J. Owen, Victor Fung, Abhishek Mitra, Austin Cheng, Emma Bouchard, Shams Mehdi
arXiv AI
Jun 16

Can Artificial Intelligence Accelerate Technological Progress? Researchers' Perspectives on AI in Manufacturing and Materials Science

arXiv:2511. 14007v3 Announce Type: replace-cross Abstract: Artificial intelligence (AI) raises expectations of substantial increases in rates of technological progress, but such anticipations are often not connected to detailed ground-level studies of AI use in innovation processes.

By John P. Nelson, Olajide Olugbade, Philip Shapira, Justin B. Biddle
arXiv Machine Learning
Aug 19

Wasted large language models: A life cycle thinking approach

The paper argues that large language models (LLMs) have a growing carbon footprint and that current efficiency gains are offset by rebound effects such as Jevons Paradox. It proposes applying the EU waste hierarchy—prevention, reuse, recycling, recovery, and disposal—to LLMs, suggesting that preventing waste and unnecessary use can significantly reduce environmental impact. The authors emphasize that treating LLMs as products that can become waste offers new ways to motivate more sustainable practices.

By Erik Johannes Husom, Maria Emine Nylund, Ophelia Prillard
MIT News AI
Aug 4

Solving the solvent problem

By focusing on electrolytes, MIT scientists are making sodium-metal batteries a more practical energy storage option.

By Steve Nadis | Department of Nuclear Science and Engineering
Meta AI Research
Apr 17, 2023

Every tree counts

Meta set a goal to reach net zero emissions by 2030. We are developing technology to mitigate our carbon footprint and making these openly available.

MIT News AI
Aug 26

AI helps design new materials that work in the real world

The MIT-developed tool "CrysVCD" uses AI to design new materials that are chemically stable in real-world conditions. By predicting stability early, it can significantly reduce the time and cost associated with testing and discarding unstable material designs.

By Zach Winn | MIT News
arXiv AI
4d ago

Atoms to Processes: The Role of Artificial Intelligence and Machine Learning in Chemical Engineering

The article discusses how the rapid development of artificial intelligence (AI) and machine learning (ML) is transforming chemical engineering by influencing problem formulation, analysis, and solution across a wide range of applications, from atomic-scale simulations to industrial operations. It highlights recent methodological advances and representative uses, noting a shift from purely black-box models to hybrid and physics-informed frameworks that incorporate conservation laws, thermodynamic consistency, and structural constraints. These integrated approaches enhance robustness, reliability, and human-AI collaboration, ultimately amplifying rather than replacing core chemical engineering principles.

By Michael Baldea, Linda J. Broadbelt, Marianthi G. Ierapetritou, Akhilesh Jain, Ankur Kumar, Thomas A. Kwan, F\`elix Llovell, Andrew J. Medford, Ilias Mitrai, Joel Paulson, Junyi Qiao, Matthew P. Rivera, Kirti C. Sahu, Lev Sarkisov, Zachary P. Smith, Calvin Tsay, Ching-Mei Wen, Victor M. Zavala, Huacheng Zhang, Dan Zhao