Monotonic data fitting and interpolation with application to postprocessing of FE solutions

• In this talk we consider the isotonic regression (IR) problem which can be formulated as follows. Given a vector $\bar{x} \in R^n$, find $x_* \in R^n$ which solves the problem: \begin{equation}\label{ir2} \begin{array}{cl} \mbox{min} & \|x-\bar{x}\|^2 \\ \mbox{s.t.} & Mx \ge 0. \end{array} \end{equation} The set of constraints $Mx \ge 0$ represents here the monotonicity relations of the form $x_i \le x_j$ for a given set of pairs of the components of $x$. The corresponding row of the matrix $M$ is composed mainly of zeros, but its $i$th and $j$th elements, which are equal to $-1$ and $+1$, respectively. The most challenging applications of (\ref{ir2}) are characterized by very large values of $n$. We introduce new IR algorithms. Our numerical experiments demonstrate the high efficiency of our algorithms, especially for very large-scale problems, and their robustness. They are able to solve some problems which all existing IR algorithms fail to solve. We outline also our new algorithms for monotonicity-preserving interpolation of scattered multivariate data. In this talk we focus on application of our IR algorithms in postprocessing of FE solutions. Non-monotonicity of the numerical solution is a typical drawback of the conventional methods of approximation, such as finite elements (FE), finite volumes, and mixed finite elements. The problem of monotonicity is particularly important in cases of highly anisotropic diffusion tensors or distorted unstructured meshes. For instance, in the nuclear waste transport simulation, the non-monotonicity results in the presence of negative concentrations which may lead to unacceptable concentration and chemistry calculations failure. Another drawback of the conventional methods is a possible violation of the discrete maximum principle, which establishes lower and upper bounds for the solution. We suggest here a least-change correction to the available FE solution $\bar{x} \in R^n$. This postprocessing procedure is aimed on recovering the monotonicity and some other important properties that may not be exhibited by $\bar{x}$. The mathematical formulation of the postprocessing problem is reduced to the following convex quadratic programming problem \begin{equation}\label{ls2} \begin{array}{cl} \mbox{min} & \|x-\bar{x}\|^2 \\ \mbox{s.t.} & Mx \ge 0, \quad l \le x \le u, \quad e^Tx = m, \end{array} \end{equation} where$e=(1,1, \ldots ,1)^T \in R^n$. The set of constraints $Mx \ge 0$ represents here the monotonicity relations between some of the adjacent mesh cells. The constraints $l \le x \le u$ originate from the discrete maximum principle. The last constraint formulates the conservativity requirement. The postprocessing based on (\ref{ls2}) is typically a large scale problem. We introduce here algorithms for solving this problem. They are based on the observation that, in the presence of the monotonicity constraints only, problem (\ref{ls2}) is the classical monotonic regression problem, which can be solved efficiently by some of the available monotonic regression algorithms. This solution is used then for producing the optimal solution to problem (\ref{ls2}) in the presence of all the constraints. We present results of numerical experiments to illustrate the efficiency of our algorithms.

Ämnesord

NATURVETENSKAP  -- Data- och informationsvetenskap -- Datavetenskap (hsv//swe)

NATURAL SCIENCES  -- Computer and Information Sciences -- Computer Sciences (hsv//eng)

Nyckelord

Computer science

Datavetenskap

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