This series of three papers describes a cross‐validation method to estimate the spatial covariance structure of intrinsic or nonintrinsic random functions from point or spatially averaged data that may be corrupted by noise. Any number of relevant parameters, including nugget effect, can be estimated. The theory, described in this paper, is based on a maximum likelihood approach which treats the cross‐validation errors as Gaussian. Various a posteriori statistical tests are used to verify this hypothesis and to show that in many cases, correlation between these errors is weak. The log likelihood criterion is optimized through a combination of conjugate gradient algorithms. An adjoint state theory is used to efficiently calculate the gradient of the estimation criterion, optimize the step size downgradient, and compute a lower bound for the covariance matrix of the estimation errors. Issues related to the identifiability, stability, and uniqueness of the resulting adjoint state maximum likelihood cross‐validation (ASMLCV) method are discussed. This paper also describes the manner in which ASMLCV allows one to use model structure identification criteria to select the best covariance model among a given set of alternatives. Practical aspects of ASMLCV and its application to synthetic data are presented in paper 2 (Samper and Neuman, this issue (a)). Applications to real hydrogeological data (transmissivities and groundwater levels) have been presented elsewhere, while hydrochemical and isotopic data are analyzed by ASMLCV in paper 3 (Samper and Neuman, this issue (b)).
ASJC Scopus subject areas
- Water Science and Technology