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Computational Modeling

Upward band gap bowing and negative mixing enthalpy in multi-component cubic halide perovskite alloys
Feb 25, 2026
PHYSICAL REVIEW MATERIALS, 2026, 10, 025405
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High-Energy Hybridized States Enable Long-Lived Hot Electrons in Cobaloxime-Silicon Nanocrystal System
Feb 8, 2026
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2026, 148, 6, 6412-6421
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How one engineering alum optimizes clean energy operations before they break
Feb 5, 2026
January 2026
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Origins of anisotropic linear magnetoresistance with isotropic mobility in Cd3As2 films on GaAs[110]
Jan 16, 2026
JOURNAL OF APPLIED PHYSICS, 2026, 139, 035102
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Impact of Cation Insertion on Semiconducting Polymer Thin Films toward Electrochemical Energy Conversion
Jan 8, 2026
CHEMISTRY OF MATERIALS, 2026, 38, 2, 630-644
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Saturation of the kinetic ballooning instability due to the electron parallel nonlinearity
Dec 19, 2025
PHYSICS OF PLASMAS, 2025, 32, 124501
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Adiabatic cooling of planar motion in a Penning-trap ion crystal to sub-millikelvin temperatures
Dec 11, 2025
PHYSICAL REVIEW A, 2025, 112, 063110
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The Grid’s New Shock Absorber: ‘Droop-e’ Control tames frequency swings and keeps renewable energy flowing smoothly
Dec 9, 2025
December 2025
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Kyri Baker featured on Marketplace: Power demand of data centers keeps exceeding expectations
Dec 2, 2025
December 2025
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Mic-hackathon 2024: hackathon on machine learning for electron and scanning probe microscopy
Dec 2, 2025
MACHINE LEARNING SCIENCE AND TECHNOLOGY, 2025, 6, 4, 040701
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