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Creators/Authors contains: "Guan, Yifei"

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  1. Yortsos, Yannis (Ed.)
    Abstract Transfer learning (TL), which enables neural networks (NNs) to generalize out-of-distribution via targeted re-training, is becoming a powerful tool in scientific machine learning (ML) applications such as weather/climate prediction and turbulence modeling. Effective TL requires knowing (1) how to re-train NNs? and (2) what physics are learned during TL? Here, we present novel analyses and a framework addressing (1)–(2) for a broad range of multi-scale, nonlinear, dynamical systems. Our approach combines spectral (e.g. Fourier) analyses of such systems with spectral analyses of convolutional NNs, revealing physical connections between the systems and what the NN learns (a combination of low-, high-, band-pass filters and Gabor filters). Integrating these analyses, we introduce a general framework that identifies the best re-training procedure for a given problem based on physics and NN theory. As test case, we explain the physics of TL in subgrid-scale modeling of several setups of 2D turbulence. Furthermore, these analyses show that in these cases, the shallowest convolution layers are the best to re-train, which is consistent with our physics-guided framework but is against the common wisdom guiding TL in the ML literature. Our work provides a new avenue for optimal and explainable TL, and a step toward fully explainable NNs, for wide-ranging applications in science and engineering, such as climate change modeling. 
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  2. Abstract There is growing interest in discovering interpretable, closed‐form equations for subgrid‐scale (SGS) closures/parameterizations of complex processes in Earth systems. Here, we apply a common equation‐discovery technique with expansive libraries to learn closures from filtered direct numerical simulations of 2D turbulence and Rayleigh‐Bénard convection (RBC). Across common filters (e.g., Gaussian, box), we robustly discover closures of the same form for momentum and heat fluxes. These closures depend on nonlinear combinations of gradients of filtered variables, with constants that are independent of the fluid/flow properties and only depend on filter type/size. We show that these closures are the nonlinear gradient model (NGM), which is derivable analytically using Taylor‐series. Indeed, we suggest that with common (physics‐free) equation‐discovery algorithms, for many common systems/physics, discovered closures are consistent with the leading term of the Taylor‐series (except when cutoff filters are used). Like previous studies, we find that large‐eddy simulations with NGM closures are unstable, despite significant similarities between the true and NGM‐predicted fluxes (correlations >0.95). We identify two shortcomings as reasons for these instabilities: in 2D, NGM produces zero kinetic energy transfer between resolved and subgrid scales, lacking both diffusion and backscattering. In RBC, potential energy backscattering is poorly predicted. Moreover, we show that SGS fluxes diagnosed from data, presumed the “truth” for discovery, depend on filtering procedures and are not unique. Accordingly, to learn accurate, stable closures in future work, we propose several ideas around using physics‐informed libraries, loss functions, and metrics. These findings are relevant to closure modeling of any multi‐scale system. 
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  3. Abstract Neural networks (NNs) are increasingly used for data‐driven subgrid‐scale parameterizations in weather and climate models. While NNs are powerful tools for learning complex non‐linear relationships from data, there are several challenges in using them for parameterizations. Three of these challenges are (a) data imbalance related to learning rare, often large‐amplitude, samples; (b) uncertainty quantification (UQ) of the predictions to provide an accuracy indicator; and (c) generalization to other climates, for example, those with different radiative forcings. Here, we examine the performance of methods for addressing these challenges using NN‐based emulators of the Whole Atmosphere Community Climate Model (WACCM) physics‐based gravity wave (GW) parameterizations as a test case. WACCM has complex, state‐of‐the‐art parameterizations for orography‐, convection‐, and front‐driven GWs. Convection‐ and orography‐driven GWs have significant data imbalance due to the absence of convection or orography in most grid points. We address data imbalance using resampling and/or weighted loss functions, enabling the successful emulation of parameterizations for all three sources. We demonstrate that three UQ methods (Bayesian NNs, variational auto‐encoders, and dropouts) provide ensemble spreads that correspond to accuracy during testing, offering criteria for identifying when an NN gives inaccurate predictions. Finally, we show that the accuracy of these NNs decreases for a warmer climate (4 × CO2). However, their performance is significantly improved by applying transfer learning, for example, re‐training only one layer using ∼1% new data from the warmer climate. The findings of this study offer insights for developing reliable and generalizable data‐driven parameterizations for various processes, including (but not limited to) GWs. 
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