Data eccentricity, asymptotics of Gaussian RBF reproducing kernel Hilbert space, and kernel PCA

The Gaussian kernel is a widely used similarity measure underlying kernel methods such as kernel PCA and spectral clustering, but computing Gaussian kernel distances for many pairs of points can be expensive. Using Random Fourier Features (RFF), Chen and Phillips [ALT 2017] showed that for points in a $d$-dimensional Euclidean ball in ${\mathbb R}^N$, $t=Ω((d/\varepsilon^2)\log(dR/\varepsilon))$ features suffice to preserve all pairwise Gaussian kernel distances within a $(1\pm\varepsilon)$ factor with high probability. We establish a uniform relative-error embedding theorem for the more general setting of an arbitrary positive-reach submanifold $\mathcal M\subset{\mathbb R}^N$ of intrinsic dimension $d$. We show that $t=O((d/\varepsilon^2)\log(\operatorname{vol}(\mathcal M)^2N^{2d}/(\operatorname{vol}(B_1^d(0))^2\operatorname{rch}(\mathcal M)^{2d}\varepsilon^{2d+1}δ)))$, or approximately $O((d^2/\varepsilon^2)(\log N+\log(1/(\varepsilonδ))))$, RFFs suffice, with probability $1-δ$, to preserve the Gaussian kernel distance between every pair of manifold points up to relative error $\varepsilon$. Thus the bound depends only logarithmically on the ambient dimension and on manifold parameters such as volume and reach, while retaining the $1/\varepsilon^2$ Euclidean rate. We also prove a topological consequence: under the same RFF embedding, persistent homology is preserved in the sense that weighted Cech and Rips filtrations built from Gaussian kernel power distance are $(1\pm\varepsilon_\star)$-interleaved, where $\varepsilon_\star$ accounts for both distance distortion and kernel-weight approximation.

We propose a family of random feature maps for scalable kernel machines on low-dimensional subspaces, ie on the Grassmannian manifold. Such representations are useful when data classes or clusters are well described by the span of a few samples. Classical Grassmannian kernels, including the projection and Binet-Cauchy kernels, require full Gram matrices, which leads to prohibitive computational and memory costs for large high-dimensional subspace datasets. We address this limitation using random features based on rank-one projections of subspace projection matrices followed by bounded non-linear transforms, either periodic or binary, to control the resulting distributions. We show that inner products in the random feature space approximate well-defined rotation-invariant Grassmannian kernels that depend only on the principal angles between subspaces. When the number of features is sufficiently large relative to the intrinsic subspace dimension, the approximation holds uniformly over all fixed-dimensional subspaces with high probability. For periodic transforms, the approximated kernel has a closed-form expression with tunable behaviour between inverse Binet-Cauchy and Gaussian-type regimes. Binary transforms yield compact one-bit subspace features, although no closed-form kernel is known. Structured rank-one projections based on randomised fast Fourier transforms further reduce computation without sacrificing practical accuracy. Experiments on synthetic data and ETH-80 classification tasks show that these features accurately preserve Grassmannian geometry while reducing computation, memory, and storage. Rank-one embeddings therefore provide a practical and scalable alternative to classical Grassmannian kernels.

This monograph studies the relations between two approaches using positive definite kernels: probabilistic methods using Gaussian processes, and non-probabilistic methods using reproducing kernel Hilbert spaces (RKHS). They are widely studied and used in machine learning, statistics, and numerical analysis. We study connections and equivalences for fundamental topics such as regression, interpolation, numerical integration, distributional discrepancies, and statistical dependence, as well as sample path properties of Gaussian processes. A unifying perspective for these equivalences is established, based on the equivalence between the Gaussian Hilbert space and the RKHS. The monograph serves as a basis to bridge many other methods based on Gaussian processes and reproducing kernels, which are developed in parallel by the two research communities.