GLOBE: Accurate Surrogates for Boundary-Driven PDEs via Domain-Inspired Architectures and Equivariance

원문 초록

We introduce GLOBE, a nonlinear neural surrogate for boundary-driven, homogeneous, weakly nonlinear PDEs that draws inductive bias from boundary-element methods and equivariant ML, representing solutions as superpositions of learnable Green's-function-like kernels evaluated from boundary faces to targets. The architecture is translation-, rotation-, and parity-equivariant; discretization-invariant; and units-invariant via rigorous nondimensionalization. On AirFRANS (steady incompressible RANS over NACA airfoils), a compact ~117k-parameter GLOBE model has lower mean-squared error than published values for the strongest reported ML surrogates on both the interpolation and low-data splits, in single-run comparisons under the released AirFRANS normalization. The model evaluates fields at arbitrary points, handles non-watertight meshes, and generalizes under Reynolds number and angle-of-attack distribution shifts. We further introduce a hierarchical Barnes-Hut acceleration that exploits the kernel's far-field decay to reduce evaluation cost from quadratic to near-linear in the number of boundary elements, with a tunable opening angle that recovers exact dense evaluation in the zero-angle limit. Quantitative validation focuses on 2D AirFRANS; on 3D DrivAerML cars, GLOBE predicts surface and volume fields on the full meshes, and we compare it with a matched Transolver baseline. Together, these results show that boundary-element-inspired inductive biases can substantially improve the accuracy of ML surrogates for boundary-driven PDEs while scaling to large 3D meshes.