A research team affiliated with UNIST has reported a new simulation tool to better understand how liquid-phase chemical ...

Molecular simulations serve as a crucial tool in the quantitative understanding of chemical reaction equilibria by bridging atomistic interactions and macroscopic phenomena. Through advanced ...

Professor Emeritus John Falconer earned the Thomas and Donna Edgar CACHE Award for Excellence in Chemical Engineering Education for 2021, a recognition for leading the development of online ...

Chemical dynamics simulations have emerged as a pivotal tool for unravelling the intricate processes underlying ion fragmentation and energy transfer. These computational studies employ ab initio and ...

A new study from Tel Aviv University discovered that a known practice in information technology can also be applied to chemistry. Researchers found that to enhance the sampling in chemical simulations ...

Berlin and Munich, 29 th July 2024 – Quantistry, a Berlin-based start-up offering a cloud-native chemical simulation platform, and IQM Quantum Computers announced today a memorandum of understanding ...

At the air-water interface, a negatively charged amino acid carries out a nucleophile attack on a gas molecule to convert it into a product. The reaction rate is enhanced due to significant reduction ...

For decades, EU chemical regulation has struggled with slow approvals, high costs, and ecological surprises. From delayed ...