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FluxFEM: A weak-form-centric differentiable finite element framework in JAX

Project description

PyPI version License: Apache-2.0 Python Version CI CI DOI

FluxFEM

A weak-form-centric differentiable finite element framework in JAX, where variational forms are treated as first-class, differentiable programs.

Examples and Features

Example 1: Diffusion Example 2: Neo Neohookean Hyper Elasticity
Diffusion-mms Neo-Hookean

Features

  • Built on JAX, enabling automatic differentiation with grad, jit, vmap, and related transformations.
  • Weak-form–centric API that keeps formulations close to code; weak forms are represented as expression trees and compiled into element kernels, enabling automatic differentiation of residuals, tangents, and objectives.
  • Two assembly approaches: tensor-based (scikit-fem–style) assembly and weak-form-based assembly.
  • Handles both linear and nonlinear analyses with AD in JAX.
  • Optional PETSc/PETSc-shell solvers via petsc4py for scalable linear solves (add fluxfem[petsc]).

Usage

This library provides two assembly approaches.

  • A tensor-based assembly, where trial and test functions are represented explicitly as element-level tensors and assembled accordingly (in the style of scikit-fem).
  • A weak-form-based assembly, where the variational form is written symbolically and compiled before assembly.

The two approaches are functionally equivalent and share the same element-level execution model, but they differ in how you author the weak form. The example below mirrors the paper's diffusion case and makes the distinction explicit with jnp.

Assembly Flow

All expressions are first compiled into an element-level evaluation plan, which operates on quadrature-point–major tensors. This plan is then executed independently for each element during assembly.

As a result, both assembly approaches:

  • use the same quadrature-major (q, a, i) data layout,
  • perform element-local tensor contractions,
  • and are fully compatible with JAX transformations such as jit, vmap, and automatic differentiation.

kernel-based assembly (explicit JIT units)

If you want to control JIT boundaries explicitly, build a JIT-compiled element kernel and pass it to space.assemble. The kernel must return the integrated element contribution (not the quadrature integrand). For untagged raw kernels, pass kind=.

import fluxfem as ff
import jax
import jax.numpy as jnp

space = ff.make_hex_space(mesh, dim=1, intorder=2)

# bilinear: kernel(ctx) -> (n_ldofs, n_ldofs)
ker_K = ff.make_element_bilinear_kernel(ff.diffusion_form, 1.0, jit=True)
K = space.assemble(ff.diffusion_form, 1.0, kernel=ker_K)

# linear: kernel(ctx) -> (n_ldofs,)
def linear_kernel(ctx):
    integrand = ff.scalar_body_force_form(ctx, 2.0)
    wJ = ctx.w * ctx.test.detJ
    return (integrand * wJ[:, None]).sum(axis=0)

ker_F = jax.jit(linear_kernel)
F = space.assemble(ff.scalar_body_force_form, 2.0, kernel=ker_F)

tensor-based vs weak-form-based (diffusion example)

tensor-based assembly

The tensor-based assembly provides an explicit, low-level formulation with element kernels written using jax.numpy.(jnp).

import fluxfem as ff
import jax.numpy as jnp

@ff.kernel(kind="bilinear", domain="volume")
def diffusion_form(ctx: ff.FormContext, kappa):
    # ctx.test.gradN / ctx.trial.gradN: (n_qp, n_nodes, dim)
    # output tensor: (n_qp, n_nodes, n_nodes)
    return kappa * jnp.einsum("qia,qja->qij", ctx.test.gradN, ctx.trial.gradN)

space = ff.make_hex_space(mesh, dim=3, intorder=2)
params = ff.Params(kappa=1.0)
K_ts = space.assemble(diffusion_form, params=params.kappa)

weak-form-based assembly

In the weak-form-based assembly, the variational formulation itself is the primary object. The expression below defines a symbolic computation graph, which is later compiled and executed at the element level.

import fluxfem as ff
import fluxfem.helpers_wf as h_wf

space = ff.make_hex_space(mesh, dim=3, intorder=2)
params = ff.Params(kappa=1.0)

# u, v are symbolic trial/test fields (weak-form DSL objects).
# u.grad / v.grad are symbolic nodes (expression tree), not numeric arrays.
# dOmega() is the integral measure; the whole expression is compiled before assembly.
form_wf = ff.BilinearForm.volume(
    lambda u, v, p: p.kappa * (v.grad @ u.grad) * h_wf.dOmega()
).get_compiled()

K_wf = space.assemble(form_wf, params=params)

Linear Elasticity assembly (weak-form based assembly)

import fluxfem as ff
import fluxfem.helpers_wf as h_wf

space = ff.make_hex_space(mesh, dim=3, intorder=2)
D = ff.isotropic_3d_D(1.0, 0.3)

form_wf = ff.BilinearForm.volume(
    lambda u, v, D: h_wf.ddot(v.sym_grad, D @ u.sym_grad) * h_wf.dOmega()
).get_compiled()

K = space.assemble(form_wf, params=D)

Neo-Hookean residual assembly (weak-form DSL)

Below is a Neo-Hookean hyperelasticity example written in weak form. The residual is expressed symbolically and compiled into element-level kernels executed per element. No manual derivation of tangent operators is required; consistent tangents (Jacobians) for Newton-type solvers are obtained automatically via JAX AD.

def neo_hookean_residual_wf(v, u, params):
    mu = params["mu"]
    lam = params["lam"]
    F = h_wf.I(3) + h_wf.grad(u)  # deformation gradient
    C = h_wf.matmul(h_wf.transpose(F), F)
    C_inv = h_wf.inv(C)
    J = h_wf.det(F)

    S = mu * (h_wf.I(3) - C_inv) + lam * h_wf.log(J) * C_inv
    dE = 0.5 * (h_wf.matmul(h_wf.grad(v), F) + h_wf.transpose(h_wf.matmul(h_wf.grad(v), F)))
    return h_wf.ddot(S, dE) * h_wf.dOmega()

res_form = ff.ResidualForm.volume(neo_hookean_residual_wf).get_compiled()

autodiff + jit compile

You can differentiate through the solve and JIT compile the hot path. The inverse diffusion tutorial shows this pattern:

def loss_theta(theta):
    kappa = jnp.exp(theta)
    u = solve_u_jit(kappa, traction_true)
    diff = u[obs_idx_j] - u_obs[obs_idx_j]
    return 0.5 * jnp.mean(diff * diff)

solve_u_jit = jax.jit(solve_u)
loss_theta_jit = jax.jit(loss_theta)
grad_fn = jax.jit(jax.grad(loss_theta))

FESpace vs FESpacePytree

Use FESpace for standard workflows with a fixed mesh. When you need to carry the space through JAX transformations (e.g., shape optimization where mesh coordinates are part of the computation), use FESpacePytree via make_*_space_pytree(...). This keeps the mesh/basis in the pytree so jax.jit/jax.grad can see geometry changes.

Mixed systems

Mixed problems can be assembled from residual blocks and solved as a coupled system.

import fluxfem as ff
import jax.numpy as jnp

mixed = ff.MixedFESpace({"u": space_u, "p": space_p})
residuals = ff.make_mixed_residuals(
    u=res_u,  # (v, u, params) -> Expr
    p=res_p,  # (q, u, params) -> Expr
)
problem = ff.MixedProblem(mixed, residuals, params=ff.Params(alpha=1.0))

u0 = jnp.zeros(mixed.n_dofs)
R = problem.assemble_residual(u0)
J = problem.assemble_jacobian(u0, return_flux_matrix=True)

Block assembly

For constraints like contact problems (e.g., adding Lagrange multipliers), build a block matrix explicitly:

from fluxfem import solver as ff_solver

# Example blocks from contact coupling
K_uu = ...
K_cc = ...
K_uc = ...

blocks = ff_solver.make_block_matrix(
    diag=ff_solver.block_diag(u=K_uu, c=K_cc),
    rel={("u", "c"): K_uc},
    sizes={"u": K_uu.shape[0], "c": K_cc.shape[0]},
    symmetric=True,
    transpose_rule="T",
)

# Lazy container; assemble when you need the global matrix.
K = blocks.assemble()

FluxFEM also provides contact utilities like ContactSurfaceSpace to build constraint contributions.

Documentation

Full documentation, tutorials, and API reference are hosted at this site.

Tutorials

  • tutorials/linearelastic_tensile_bar.py (linear elasticity, weak-form assembly)
  • tutorials/neo_hookean_cantilever.py (nonlinear hyperelasticity)
  • tutorials/thermoelastic_bar_1d.py / tutorials/thermoelastic_bar_1d_mixed.py (thermoelastic coupling)
  • tutorials/petsc_shell_poisson_demo.py (PETSc shell solver integration; see also tutorials/petsc_shell_poisson_pmat_demo.py)

Setup

You can install FluxFEM either via pip or Poetry.

Supported Python Versions

FluxFEM supports Python 3.11–3.13:

Choose one of the following methods:

Using pip

pip install fluxfem
pip install "fluxfem[cuda12]" -f https://storage.googleapis.com/jax-releases/jax_cuda_releases.html

Using poetry

poetry add fluxfem
poetry add fluxfem[cuda12]

PETSc Integration

Optional PETSc-based solvers are available via petsc4py. Enable with the extra:

poetry add fluxfem --extras "petsc"

Note: newer petsc4py expects PETSc builds that include the PetscRegressor API. If your PETSc build does not have it, petsc4py will fail to compile. In that case, rebuild PETSc with regressor support or pin petsc4py to a version compatible with your PETSc build.

GPU note: this repo currently tests CUDA via the cuda12 extra only. Other CUDA versions are not covered by CI and may require manual JAX installation.

Acknowledgements

I acknowledge the open-source software, libraries, and communities that made this work possible.

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