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Tag: density-functional theory

  • Diamond Defects Maintain Stable Light Emission under Extreme Pressure
    Quantum Research News

    Diamond Defects Stable Under Extreme Pressure

    by Muhammad Rohail T.February 14, 2026
  • AI Leap Predicts Behaviour of Twisted Materials, Bypassing Supercomputer Limits
    Artificial Intelligence

    AI Predicts Twisted Material Behavior

    by Muhammad Rohail T.February 12, 2026
  • Chemistry’s Core Calculations Become More Accurate with Simplified Modelling Technique
    Quantum Computing Business News

    DFT Accuracy Boosted by Simplified Modeling

    by Muhammad Rohail T.February 9, 2026
  • AI Cuts Quantum Material Simulations from Years to Minutes
    Quantum Simulation

    AI Cuts Quantum Material Simulations from Years to Minutes

    by Physics NewsFebruary 3, 2026
  • Researchers Demonstrate Complex Magnetic Phases in Clinoatacamite below 18.1 K
    Physics

    Clinoatacamite Shows Complex Magnetic Phases at 18.1K

    by Muhammad Rohail T.February 2, 2026
  • So3lr Force Field Achieves Unprecedented Accuracy Matching DFT for 23 Bio-Relevant Molecules
    Quantum Machine Learning

    SO3LR Force Field Rivals DFT Accuracy for Biomolecules

    by Muhammad Rohail T.January 19, 2026
  • Boron Cages Achieve Stability with 32 and 92 Atoms, Enabling Optoelectronic Applications
    Technology

    Boron Cages: Stable Clusters for Optoelectronics

    by Muhammad Rohail T.December 30, 2025
  • Tunable Topological Phases Enable Novel Quantum Materials with Protected Edge Spins
    Physics

    Tunable Topological Phases & Protected Edge Spins

    by Muhammad Rohail T.December 19, 2025
  • Dft Implementation Within FLAPW Method Enables Accurate Calculations and Validates $GW$ Results
    Technology

    DFT & FLAPW Validate $GW$ Material Calculations

    by Muhammad Rohail T.November 15, 2025
  • Aza-triangulene Kagome Lattices Demonstrate Phase-Frustration and Stabilize Sixfold Degenerate Quantum Bands
    Technology

    Kagome Lattices Stabilize Degenerate Quantum Bands

    by Muhammad Rohail T.October 23, 2025
  • Gate-tunable Superconductivity in Monolayer WTe Exhibits Anomalies Beyond Standard Theory, Revealing Critical Carrier Density Effects
    Quantum Technology

    WTe Superconductivity: Critical Density Effects

    by Dr. DonovanSeptember 11, 2025
  • Researchers Boost Magnetism Models, Improving Data Tech
    Quantum Research News

    Researchers Boost Magnetism Models, Improving Data Tech

    by Dr. DonovanAugust 20, 2025
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