Solver-in-the-loop training of deep learning closures for large-eddy simulation of turbulent premixed jet flames

Abstract

Large-eddy simulation (LES) turbulence models often fail to capture the effects of chemical heat release and the resulting modulation of turbulence in premixed flames, underscoring the need for a framework that remains accurate across a broad range of physical regimes. We develop an augmented eddy-viscosity closure, based on deep neural networks calibrated jointly with the LES solution using adjoint-based optimization and differentiable programming, ensuring consistency with the governing partial differential equations (PDEs). Several objective functions and training methods are examined, and each model is assessed for its capability to interpolate and extrapolate across a wide range of Damk\"ohler numbers. Relative to the Smagorinsky-model baseline, the best neural network model improves a posteriori errors in the LES primitive variables by 25-50% and in the resolved Reynolds stress and scalar flux by more than 60%. Crucially, the model generalizes across Damk\"ohler number regimes, maintaining stability and accuracy even for out-of-sample conditions. These results demonstrate that PDE-consistent deep learning closures can recover both mean fields and resolved turbulence statistics in LES of turbulent premixed flames and can therefore provide a broadly applicable framework for turbulent combustion modeling.