Deep learning-based methods have shown remarkable effectiveness in solving PDEs, largely due to their ability to enable fast simulations once trained. However, despite the availability of high-performance computing infrastructure, many critical applications remain constrained by the substantial computational costs associated with generating large-scale, high-quality datasets and training models. In this work, inspired by studies on the structure of Green's functions for elliptic PDEs, we introduce Neural-HSS, a parameter-efficient architecture built upon the Hierarchical Semi-Separable (HSS) matrix structure that is provably data-efficient for a broad class of PDEs. We theoretically analyze the proposed architecture, proving that it satisfies exactness properties even in very low-data regimes. We also investigate its connections with other architectural primitives, such as the Fourier neural operator layer and convolutional layers. We experimentally validate the data efficiency of Neural-HSS on the three-dimensional Poisson equation over a grid of two million points, demonstrating its superior ability to learn from data generated by elliptic PDEs in the low-data regime while outperforming baseline methods. Finally, we demonstrate its capability to learn from data arising from a broad class of PDEs in diverse domains, including electromagnetism, fluid dynamics, and biology.
Figures & tables
Figure 1: Model overview. The lifting and projection layers can be implemented either as HSS layers or as full-rank layers. We illustrate, as an example, the weight matrix structure with two different hierarchical levels.
Figure 2: Train size vs relative test error for different models. The models are trained on a 1D Poisson equation.
Figure 3: Left : Train size vs relative test error for different models. The models are trained on a 3D Poisson equation. Right : Timing of forward and backward for the different models.
Neural-HSS
FNO
ResNet
DeepONet
Green Learning
Equation
Params
Test Err
Params
Test Err
Params
Test Err
Params
Test Err
Params
Test Err
Heat Eq.
45 K
3×10−3
150 K
8×10−3
165 K
1×10−2
247 K
1×10−2
83 K
1×10−2
Poisson Neumann BC
37 K
2×10−4
102 K
3×10−3
165 K
4×10−1
247 K
9×10−3
83 K
3×10−3
Burgers’ Eq.
1.5 M
0.12
1.5 M
0.26
1.7 M
0.57
1.7 M
0.44
-
-
Table 1: Comparison between Neural-HSS and baseline models. We report the number of learnable parameters for each model and the test error Eq. 3 .
Neural-HSS
FNO
ResNet
DeepONet
Green Learning
FactFormer
Equation
Params
Test Err
Params
Test Err
Params
Test Err
Params
Test Err
Params
Test Err
Params
Test Err
Poisson Eq.
37K
7×10−8
132 K
7×10−6
165 K
3×10−4
280 K
2×10−2
83 K
5×10−5
3.9 M
6×10−3
Poisson Eq. (Mixed BC)
37 K
1×10−4
132 K
6×10−3
165 K
8×10−2
280 K
4×10−1
83 K
1×10−2
3.9 M
7×10−2
Poisson Eq. (L-shape domain)
37 K
2×10−2
132 K
2×10−1
165 K
7×10−1
280 K
8×10−1
83 K
5×10−1
3.9 M
2×10−1
Helmholtz equation
37 K
6×10−3
132 K
5×10−2
165 K
1×100
280 K
1×100
83 K
1×100
3.9 M
7×10−2
Gray–Scott Eq. (Forward)
329K
0.294
2.1M
0.331
1.99M
0.273
2.3M
0.315
-
-
3.9M
0.291
Table 2: Comparison between Neural-HSS and baseline models on 2D problems. We report the number of learnable parameters for each model and the test error Equation 2 . With NS Eq., we refer to the incompressible Navier-Stokes equation.
Appendix figures & tables13 assets
Supplementary material from the paper’s appendix.
Appendix
Figure 4: Train size vs relative test error for different models. The models are trained on a 3D Poisson equation
Figure 5: Ablation study on rank, outer rank, and levels for the Gray-Scott problem, where the color indicates the test error after training (rescaled from maximum to minimum observed, notice the scale in the colorbars).
Figure 6: Trajectory test loss varying β
Figure 7: Timing of one forward pass, calculated on different datasets.
Figure 8: Timing of one forward+backward pass, calculated on two different datasets: Left : Heat equation. Right : Burgers’ equation. We refer to Appendix K for inference only timings.
Figure 9: Timing of one forward+backward pass, calculated on two different datasets: Left : 2D Poisson Equation Right : Gray-Scott and Navier-Stokes.We refer to Appendix K for inference only timings.
Configuration
Neural-HSS
FNO
ResNet
DeepONet
Green Learning
Depth
3
6
12
4 1 1 1 The depth is the same for the Trunk network and the Branch network
6
Embedding Dimension
256
32
48
192
128
Activation
Trainable LeakyReLU
GeLU
GeLU
GeLU
Rational activation 2 2 2 ( Boullé et al., 2020 )
Levels
3
-
-
-
-
Rank
2
-
-
-
-
Modes
-
12
-
-
-
Appendix
Table 3: Models and training configuration for the Heat Equation and Poisson Equation with Neumann boundary conditions.
Configuration
Neural-HSS
FNO
ResNet
DeepONet
Depth
4
6
12
4
Embedding Dimension
1024
64
150
512
Activation
Trainable LeakyReLU
GeLU
GeLU
GeLU
Levels
3
-
-
-
Rank
32
-
-
-
Modes
-
32
-
-
Appendix
Table 4: Models and training configuration for the Burgers’ Equation .
Configuration
Neural-HSS
FNO
ResNet
DeepONet
Green Learning
FactFormer
Depth
3
4
4
4 3 3 footnotemark: 3
6
1
Embedding Dimension
64
16
64
64
64
384
Activation
Trainable LeakyReLU
GeLU
GeLU
GeLU
Rational activation 4 4 footnotemark: 4
GeLU
Levels
2
-
-
-
-
-
Rank
2
-
-
-
-
-
outer rank
8
-
-
-
-
-
Appendix
Table 5: Models and training configuration for the 2D Poisson Equation and 2D Poisson Equation (L-shape domain) .
Configuration
Neural-HSS
FNO
ResNet
DeepONet
Green Learning
Depth
3
4
4
4 5 5 footnotemark: 5
6
1
Embedding Dimension
64
16
64
64
64
384
Activation
Trainable LeakyReLU
GeLU
GeLU
GeLU
Rational activation 6 6 footnotemark: 6
GeLU
Levels
2
-
-
-
-
-
Rank
2
-
-
-
-
-
outer rank
8
-
-
-
-
-
Appendix
Table 6: Models and training configuration for the Helmholtz equation .
Configuration
Neural-HSS
FNO
ResNet
DeepONet
FactFormer
Depth
3
4
4
4
1
Embedding Dimension
128×128
32
64
128
384
Activation
Trainable LeakyReLU
GeLU
GeLU
GeLU
GeLU
Levels
2
-
-
-
-
Rank
8
-
-
-
-
Outer Rank
8
-
-
-
-
Appendix
Table 7: Models and training configuration for the Incompressible Navier-Stokes and Gray-Scott .
Configuration
Neural-HSS
FNO
ResNet
DeepONet
Depth
1
2
2
4
Embedding Dimension
128×128×128
14
48
128
Activation
Trainable LeakyReLU
GeLU
GeLU
GeLU
Levels
2
-
-
-
Rank
4
-
-
-
Outer Rank
2
-
-
-
Appendix
Table 8: Models and training configuration for the data efficiency for 3D Poisson Equation . We report the training steps since for each training size we match the training steps at 16 k.
Configuration
Neural-HSS
FNO
ResNet
DeepONet
Green Learning
Depth
3
6
12
4 7 7 footnotemark: 7
6
Embedding Dimension
256
32
48
192
128
Activation
Trainable LeakyReLU
GeLU
GeLU
GeLU
Rational activation 8 8 footnotemark: 8
Levels
3
-
-
-
-
Rank
2
-
-
-
-
Modes
-
12
-
-
-
Appendix
Table 9: Models and training configuration for the data efficiency for 1D Poisson Equation .
Qiuzhen College, Tsinghua University · Department of Electronic Engineering, Tsinghua University · Beijing Institute of Mathematical Sciences and Applications
Department of Computer Science & Engineering, International Institute of Information Technology Bangalore (IIIT-B), India · Department of Data Science and Artificial Intelligence, International Institute of Information Technology Bangalore (IIIT-B), India