Oak Ridge National Laboratory researchers developed an invertible neural network (INN) to effectively and efficiently solve earth-system model calibration and simulation problems.
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Quantum Monte Carlo (QMC) methods are used to find the structure and electronic band gap of 2D GeSe, determining that the gap and its nature are highly tunable by strain.
Generative machine learning models, including GANs (Generative Adversarial Networks), are a powerful tool toward searching chemical space for desired functionalities.
A numerical weather forecasting model (WRF) was used to simulate 120 storms over the Alabama-Coosa-Tallapoosa (ACT) river basin to explore the effect of climate change on probable maximum precipitation (PMP).
Achievement: Devised a novel and accurate computational technique for investigating the self-assembly of large macromolecules, and used this method to reveal the initial stages of self-assembly of the carboxysome, the prototype bacterial