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Algorithmic warm starts for Hamiltonian Monte Carlo

Zhang, Matthew S., Altschuler, Jason M., Chewi, Sinho

arXiv.org Machine Learning

Generating samples from a continuous probability density is a central algorithmic problem across statistics, engineering, and the sciences. For high-dimensional settings, Hamiltonian Monte Carlo (HMC) is the default algorithm across mainstream software packages. However, despite the extensive line of work on HMC and its widespread empirical success, it remains unclear how many iterations of HMC are required as a function of the dimension $d$. On one hand, a variety of results show that Metropolized HMC converges in $O(d^{1/4})$ iterations from a warm start close to stationarity. On the other hand, Metropolized HMC is significantly slower without a warm start, e.g., requiring $Ω(d^{1/2})$ iterations even for simple target distributions such as isotropic Gaussians. Finding a warm start is therefore the computational bottleneck for HMC. We resolve this issue for the well-studied setting of sampling from a probability distribution satisfying strong log-concavity (or isoperimetry) and third-order derivative bounds. We prove that \emph{non-Metropolized} HMC generates a warm start in $\tilde{O}(d^{1/4})$ iterations, after which we can exploit the warm start using Metropolized HMC. Our final complexity of $\tilde{O}(d^{1/4})$ is the fastest algorithm for high-accuracy sampling under these assumptions, improving over the prior best of $\tilde{O}(d^{1/2})$. This closes the long line of work on the dimensional complexity of MHMC for such settings, and also provides a simple warm-start prescription for practical implementations.


ResNets of All Shapes and Sizes: Convergence of Training Dynamics in the Large-scale Limit

Chaintron, Louis-Pierre, Chizat, Lénaïc, Maass, Javier

arXiv.org Machine Learning

We establish convergence of the training dynamics of residual neural networks (ResNets) to their joint infinite depth L, hidden width M, and embedding dimension D limit. Specifically, we consider ResNets with two-layer perceptron blocks in the maximal local feature update (MLU) regime and prove that, after a bounded number of training steps, the error between the ResNet and its large-scale limit is O(1/L + sqrt(D/(L M)) + 1/sqrt(D)). This error rate is empirically tight when measured in embedding space. For a budget of P = Theta(L M D) parameters, this yields a convergence rate O(P^(-1/6)) for the scalings of (L, M, D) that minimize the bound. Our analysis exploits in an essential way the depth-two structure of residual blocks and applies formally to a broad class of state-of-the-art architectures, including Transformers with bounded key-query dimension. From a technical viewpoint, this work completes the program initiated in the companion paper [Chi25] where it is proved that for a fixed embedding dimension D, the training dynamics converges to a Mean ODE dynamics at rate O(1/L + sqrt(D)/sqrt(L M)). Here, we study the large-D limit of this Mean ODE model and establish convergence at rate O(1/sqrt(D)), yielding the above bound by a triangle inequality. To handle the rich probabilistic structure of the limit dynamics and obtain one of the first rigorous quantitative convergence for a DMFT-type limit, we combine the cavity method with propagation of chaos arguments at a functional level on so-called skeleton maps, which express the weight updates as functions of CLT-type sums from the past.


A New Kernel Regularity Condition for Distributed Mirror Descent: Broader Coverage and Simpler Analysis

Qiu, Junwen, Zeng, Ziyang, Mei, Leilei, Zhang, Junyu

arXiv.org Machine Learning

Existing convergence of distributed optimization methods in non-Euclidean geometries typically rely on kernel assumptions: (i) global Lipschitz smoothness and (ii) bi-convexity of the associated Bregman divergence function. Unfortunately, these conditions are violated by nearly all kernels used in practice, leaving a huge theory-practice gap. This work closes this gap by developing a unified analytical tool that guarantees convergence under mild conditions. Specifically, we introduce Hessian relative uniform continuity (HRUC), a regularity satisfied by nearly all standard kernels. Importantly, HRUC is closed under concatenation, positive scaling, composition, and various kernel combinations. Leveraging the geometric structure induced by HRUC, we derive convergence guarantees for mirror descent-based gradient tracking without imposing any restrictive assumptions. More broadly, our analysis techniques extend seamlessly to other decentralized optimization methods in genuinely non-Euclidean and non-Lipschitz settings.