Chris Van de Walle, a distinguished professor of materials at UC Santa Barbara, has been awarded the American Physical Society’s 2025 Aneesur Rahman Prize for Computational Physics, the highest honor ...

Researchers from Google DeepMind in Berlin, BIFOLD, and the Technical University of Berlin have introduced a new machine ...

(Santa Barbara, Calif.) — Chris Van de Walle, a distinguished professor of materials at UC Santa Barbara, has been awarded the American Physical Society’s 2025 Aneesur Rahman Prize for Computational ...

Researchers present a comprehensive review of frontier AI applications in computational structural analysis from 2020 to 2025, focusing on graph neural networks (GNNs), sequence-to-sequence (Seq2Seq) ...

The new method can determine crystal structures underlying experimental data thus far difficult to analyze. A joint research team led by Yuuki Kubo and Shiji Tsuneyuki of the University of Tokyo has ...

Theory, computation, and simulation are foundational to modern energy research. Theoretical understanding reveals why materials and systems behave as they do, predicting performance before experiments ...

What is the Flatiron Institute? The Flatiron Institute is a newly opened private research institute that has an annual budget of $80m from the Simons Foundation – a non-profit organization that ...

Google DeepMind and collaborators have developed Euclidean Fast Attention (EFA), a machine learning method that more efficiently models global atomic interactions in complex chemical systems. This ...