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Vectorized Conditional Neural Fields: A Framework for Solving Time-dependent Parametric Partial Differential Equations

6 Jun 2024arXiv:2406.03919archive 2025-07-28

Jan Hagnberger, Marimuthu Kalimuthu, Daniel Musekamp, Mathias Niepert

Transformer models are increasingly used for solving Partial Differential Equations (PDEs). Several adaptations have been proposed, all of which suffer from the typical problems of Transformers, such as quadratic memory and time complexity. Furthermore, all prevalent architectures for PDE solving lack at least one of several desirable properties of an ideal surrogate model, such as (i) generalization to PDE parameters not seen during training, (ii) spatial and temporal zero-shot super-resolution, (iii) continuous temporal extrapolation, (iv) support for 1D, 2D, and 3D PDEs, and (v) efficient inference for longer temporal rollouts. To address these limitations, we propose Vectorized Conditional Neural Fields (VCNeFs), which represent the solution of time-dependent PDEs as neural fields. Contrary to prior methods, however, VCNeFs compute, for a set of multiple spatio-temporal query points, their solutions in parallel and model their dependencies through attention mechanisms. Moreover, VCNeF can condition the neural field on both the initial conditions and the parameters of the PDEs. An extensive set of experiments demonstrates that VCNeFs are competitive with and often outperform existing ML-based surrogate models.

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ActivationFunctionFeatureMap jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran fingerprinted MIT (permissive) · 2425561dee53dea9 · report
AttentionLayer jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran MIT (permissive) · de193a78579a115b · report
BaseMask jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran MIT (permissive) · 42c734db837c5c4f · report
FullMask jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran MIT (permissive) · 7811357b2c1e5fe9 · report
LengthMask jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran MIT (permissive) · f11fc050ba41fb3f · report
ModulatedNeuralField jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran MIT (permissive) · 7d875f9be7f69c72 · report
VCNeF jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran fingerprinted MIT (permissive) · ba00ba0ba2965717 · report
VectorizedAttentionLayer jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran MIT (permissive) · 072598f37708bf8d · report
VectorizedLinearAttention jhagnberger/vcnef/vcnef/vcnef_1d.py official repository ran MIT (permissive) · fbf3776a0b662b3c · report
LinearAttention jhagnberger/vcnef/vcnef/vcnef_1d.py official repository unverified MIT (permissive) · ccb3e8eb10824cdd · report
TransformerEncoder jhagnberger/vcnef/vcnef/vcnef_1d.py official repository unverified MIT (permissive) · 6b0304ea3035f01e · report
TransformerEncoderLayer jhagnberger/vcnef/vcnef/vcnef_1d.py official repository unverified MIT (permissive) · 87230930da2c54a6 · report
VCNeFLayer jhagnberger/vcnef/vcnef/vcnef_1d.py official repository unverified MIT (permissive) · 03d629220e9dbb5f · report
VCNeFModel jhagnberger/vcnef/vcnef/vcnef_1d.py official repository unverified MIT (permissive) · feff4c47d3fd6c26 · report

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