Diffeomorphic registration distances for Bayesian calibration of infinite-dimensional computer models

TL;DR

This paper introduces a Bayesian calibration method for infinite-dimensional computer models using diffeomorphic distances from the LDDMM framework, enabling reliable uncertainty quantification and interpretable metrics.

Contribution

It extends Bayesian calibration to infinite-dimensional outputs by employing LDDMM distances, providing a meaningful metric and a compatible probabilistic framework.

Findings

LDDMM distances effectively quantify shape differences in infinite-dimensional spaces.

The proposed method yields interpretable deformation-based metrics for calibration.

Bayesian inference can be integrated with LDDMM distances for uncertainty quantification.

Abstract

The simulation of physical phenomena with computer models relies on the estimation of physical and/or numerical parameters calibrated to fit experimental data. The approximations within the computer model and the errors in the measurements lead to uncertainties in the calibrated parameters. Bayesian calibration offers a well-studied framework to provide reliable uncertainty quantification on the calibrated parameters. When dealing with complex computer codes whose outputs are infinite-dimensional, Bayesian calibration may be extended by providing a relevant distance in the output space. In this paper, Bayesian calibration is performed using distances from the large deformation diffeomorphic metric matching (LDDMM) framework. LDDMM distances can provide a suitable metric for infinite-dimensional shapes such as scalar fields (i.e. images) or function graphs. This metric can be interpreted as the minimal energy deformation required to transform one shape into another. As such, it provides a readily interpretable metric for Bayesian calibration. On top of this, the representation of the diffeomorphism group as an exponential transformation of an RKHS is compatible with Bayesian inference and allows to define a predictive posterior distribution on the infinite-dimensional space shape.