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Bayesian quadrature for H1(μ)H^1(μ)H1(μ) with Poincaré inequality on a compact interval

29 July 2022
O. Roustant
Nora Lüthen
Fabrice Gamboa
ArXiv (abs)PDFHTML
Abstract

Motivated by uncertainty quantification of complex systems, we aim at finding quadrature formulas of the form ∫abf(x)dμ(x)=∑i=1nwif(xi)\int_a^b f(x) d\mu(x) = \sum_{i=1}^n w_i f(x_i)∫ab​f(x)dμ(x)=∑i=1n​wi​f(xi​) where fff belongs to H1(μ)H^1(\mu)H1(μ). Here, μ\muμ belongs to a class of continuous probability distributions on [a,b]⊂R[a, b] \subset \mathbb{R}[a,b]⊂R and ∑i=1nwiδxi\sum_{i=1}^n w_i \delta_{x_i}∑i=1n​wi​δxi​​ is a discrete probability distribution on [a,b][a, b][a,b]. We show that H1(μ)H^1(\mu)H1(μ) is a reproducing kernel Hilbert space with a continuous kernel KKK, which allows to reformulate the quadrature question as a Bayesian (or kernel) quadrature problem. Although KKK has not an easy closed form in general, we establish a correspondence between its spectral decomposition and the one associated to Poincar\é inequalities, whose common eigenfunctions form a TTT-system (Karlin and Studden, 1966). The quadrature problem can then be solved in the finite-dimensional proxy space spanned by the first eigenfunctions. The solution is given by a generalized Gaussian quadrature, which we call Poincar\é quadrature. We derive several results for the Poincar\é quadrature weights and the associated worst-case error. When μ\muμ is the uniform distribution, the results are explicit: the Poincar\é quadrature is equivalent to the midpoint (rectangle) quadrature rule. Its nodes coincide with the zeros of an eigenfunction and the worst-case error scales as b−a23n−1\frac{b-a}{2\sqrt{3}}n^{-1}23​b−a​n−1 for large nnn. By comparison with known results for H1(0,1)H^1(0,1)H1(0,1), this shows that the Poincar\é quadrature is asymptotically optimal. For a general μ\muμ, we provide an efficient numerical procedure, based on finite elements and linear programming. Numerical experiments provide useful insights: nodes are nearly evenly spaced, weights are close to the probability density at nodes, and the worst-case error is approximately O(n−1)O(n^{-1})O(n−1) for large nnn.

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