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Tag: Machine learning interatomic potentials

  • Accurate Quantum Simulations Now Include Effects of Heavy Elements’ Electrons
    Quantum Simulation

    Machine Learning Accurately Simulates Silicene’s Behaviour at 632 Kelvin

    by Rohail T.February 16, 2026
  • Machine Learning Materials Modelling Boosted by 6 Angstrom Efficiency Breakthrough
    Quantum Computing Business News

    Machine Learning Materials Modelling Boosted by 6 Angstrom Efficiency Breakthrough

    by Rohail T.February 5, 2026
  • Metal: Active Learning Advances High Entropy Oxide Discovery with Machine Learning Interatomic Potentials
    Emerging Technology

    Metal: Active Learning Advances High Entropy Oxide Discovery with Machine Learning Interatomic Potentials

    by Rohail T.January 13, 2026
  • Advances in Crystal Structure Prediction Unlock Superconducting Hydride Stability at 150 GPa
    Quantum Machine Learning

    Advances in Crystal Structure Prediction Unlock Superconducting Hydride Stability at 150 GPa

    by Rohail T.January 7, 2026
  • Lightpfp: Data-efficient Machine Learning Achieves Ab Initio Accuracy at Scale, Leveraging Universal Potentials for Tailored Simulations
    Quantum Technology

    Lightpfp: Data-efficient Machine Learning Achieves Ab Initio Accuracy at Scale, Leveraging Universal Potentials for Tailored Simulations

    by Rohail T.November 4, 2025
  • Researchers Achieve 17-fold Speed-up in Materials Science with Universal MLIPs and 6% Accuracy
    Artificial Intelligence

    Researchers Achieve 17-fold Speed-up in Materials Science with Universal MLIPs and 6% Accuracy

    by Quantum NewsSeptember 1, 2025
  • Researchers unlock machine learning potential with 120 million atomic configurations for materials discovery
    Machine Learning

    Researchers unlock machine learning potential with 120 million atomic configurations for materials discovery

    by Quantum NewsAugust 30, 2025
  • Machine Learning Reveals Oxygen’s Role in Strontium Titanate Ferroelectricity
    Machine Learning

    Machine Learning Reveals Oxygen’s Role in Strontium Titanate Ferroelectricity

    by Quantum NewsAugust 17, 2025
  • Machine Learning Accelerates Prediction of Defect Vibrational Properties in Solids
    Machine Learning

    Machine Learning Accelerates Prediction of Defect Vibrational Properties in Solids

    by Quantum NewsAugust 13, 2025
  • Machine Learning Predicts Elastic Properties of Lightweight Aluminum-Magnesium-Zirconium Alloys
    Machine Learning

    Machine Learning Predicts Elastic Properties of Lightweight Aluminum-Magnesium-Zirconium Alloys

    by Quantum NewsAugust 11, 2025
  • Gradient Optimisation Accelerates Machine Learning Interatomic Potential Training for Materials Science.
    Quantum Technology

    Gradient Optimisation Accelerates Machine Learning Interatomic Potential Training for Materials Science.

    by Quantum NewsJuly 2, 2025
  • Machine Learning Interatomic Potentials Accurately Model Twisted Multilayer Graphene.
    Physics

    Machine Learning Interatomic Potentials Accurately Model Twisted Multilayer Graphene.

    by Quantum NewsJune 19, 2025
  • Machine Learning Interatomic Potentials Refined by Experimental X-ray Data.
    Quantum Machine Learning

    Machine Learning Interatomic Potentials Refined by Experimental X-ray Data.

    by Quantum NewsJune 14, 2025
  • SMU Chemist Elfi Kraka Develops Machine Learning Model for Atomic-Level Interactions
    Machine Learning

    SMU Chemist Elfi Kraka Develops Machine Learning Model for Atomic-Level Interactions

    by Quantum NewsMarch 20, 2024

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