scipy.optimize.newton_krylov

scipy.optimize.newton_krylov(F, xin, iter=None, rdiff=None, method='lgmres', inner_maxiter=20, inner_M=None, outer_k=10, verbose=False, maxiter=None, f_tol=None, f_rtol=None, x_tol=None, x_rtol=None, tol_norm=None, line_search='armijo', callback=None, **kw)

Find a root of a function, using Krylov approximation for inverse Jacobian.

This method is suitable for solving large-scale problems.

Parameters:

F : function(x) -> f

Function whose root to find; should take and return an array-like object.

x0 : array_like

Initial guess for the solution

rdiff : float, optional

Relative step size to use in numerical differentiation.

method : {‘lgmres’, ‘gmres’, ‘bicgstab’, ‘cgs’, ‘minres’} or function

Krylov method to use to approximate the Jacobian. Can be a string, or a function implementing the same interface as the iterative solvers in scipy.sparse.linalg.

The default is scipy.sparse.linalg.lgmres.

inner_M : LinearOperator or InverseJacobian

Preconditioner for the inner Krylov iteration. Note that you can use also inverse Jacobians as (adaptive) preconditioners. For example,

>>> from scipy.optimize.nonlin import BroydenFirst, KrylovJacobian
>>> from scipy.optimize.nonlin import InverseJacobian
>>> jac = BroydenFirst()
>>> kjac = KrylovJacobian(inner_M=InverseJacobian(jac))

If the preconditioner has a method named ‘update’, it will be called as update(x, f) after each nonlinear step, with x giving the current point, and f the current function value.

inner_tol, inner_maxiter, ...

Parameters to pass on to the “inner” Krylov solver. See scipy.sparse.linalg.gmres for details.

outer_k : int, optional

Size of the subspace kept across LGMRES nonlinear iterations. See scipy.sparse.linalg.lgmres for details.

iter : int, optional

Number of iterations to make. If omitted (default), make as many as required to meet tolerances.

verbose : bool, optional

Print status to stdout on every iteration.

maxiter : int, optional

Maximum number of iterations to make. If more are needed to meet convergence, NoConvergence is raised.

f_tol : float, optional

Absolute tolerance (in max-norm) for the residual. If omitted, default is 6e-6.

f_rtol : float, optional

Relative tolerance for the residual. If omitted, not used.

x_tol : float, optional

Absolute minimum step size, as determined from the Jacobian approximation. If the step size is smaller than this, optimization is terminated as successful. If omitted, not used.

x_rtol : float, optional

Relative minimum step size. If omitted, not used.

tol_norm : function(vector) -> scalar, optional

Norm to use in convergence check. Default is the maximum norm.

line_search : {None, ‘armijo’ (default), ‘wolfe’}, optional

Which type of a line search to use to determine the step size in the direction given by the Jacobian approximation. Defaults to ‘armijo’.

callback : function, optional

Optional callback function. It is called on every iteration as callback(x, f) where x is the current solution and f the corresponding residual.

Returns:

sol : ndarray

An array (of similar array type as x0) containing the final solution.

Raises:

NoConvergence

When a solution was not found.

See also

scipy.sparse.linalg.gmres, scipy.sparse.linalg.lgmres

Notes

This function implements a Newton-Krylov solver. The basic idea is to compute the inverse of the Jacobian with an iterative Krylov method. These methods require only evaluating the Jacobian-vector products, which are conveniently approximated by a finite difference:

\[J v \approx (f(x + \omega*v/|v|) - f(x)) / \omega\]

Due to the use of iterative matrix inverses, these methods can deal with large nonlinear problems.

Scipy’s scipy.sparse.linalg module offers a selection of Krylov solvers to choose from. The default here is lgmres, which is a variant of restarted GMRES iteration that reuses some of the information obtained in the previous Newton steps to invert Jacobians in subsequent steps.

For a review on Newton-Krylov methods, see for example [R169], and for the LGMRES sparse inverse method, see [R170].

References

[R169]

(1, 2) D.A. Knoll and D.E. Keyes, J. Comp. Phys. 193, 357 (2004). doi:10.1016/j.jcp.2003.08.010

[R170]

(1, 2) A.H. Baker and E.R. Jessup and T. Manteuffel, SIAM J. Matrix Anal. Appl. 26, 962 (2005). doi:10.1137/S0895479803422014