20.2MLJun 15, 2022
Implicit Regularization or Implicit Conditioning? Exact Risk Trajectories of SGD in High DimensionsCourtney Paquette, Elliot Paquette, Ben Adlam et al. · deepmind
Stochastic gradient descent (SGD) is a pillar of modern machine learning, serving as the go-to optimization algorithm for a diverse array of problems. While the empirical success of SGD is often attributed to its computational efficiency and favorable generalization behavior, neither effect is well understood and disentangling them remains an open problem. Even in the simple setting of convex quadratic problems, worst-case analyses give an asymptotic convergence rate for SGD that is no better than full-batch gradient descent (GD), and the purported implicit regularization effects of SGD lack a precise explanation. In this work, we study the dynamics of multi-pass SGD on high-dimensional convex quadratics and establish an asymptotic equivalence to a stochastic differential equation, which we call homogenized stochastic gradient descent (HSGD), whose solutions we characterize explicitly in terms of a Volterra integral equation. These results yield precise formulas for the learning and risk trajectories, which reveal a mechanism of implicit conditioning that explains the efficiency of SGD relative to GD. We also prove that the noise from SGD negatively impacts generalization performance, ruling out the possibility of any type of implicit regularization in this context. Finally, we show how to adapt the HSGD formalism to include streaming SGD, which allows us to produce an exact prediction for the excess risk of multi-pass SGD relative to that of streaming SGD (bootstrap risk).
3.3PRJul 3, 2023
Fitting an ellipsoid to a quadratic number of random pointsAfonso S. Bandeira, Antoine Maillard, Shahar Mendelson et al.
We consider the problem $(\mathrm{P})$ of fitting $n$ standard Gaussian random vectors in $\mathbb{R}^d$ to the boundary of a centered ellipsoid, as $n, d \to \infty$. This problem is conjectured to have a sharp feasibility transition: for any $\varepsilon > 0$, if $n \leq (1 - \varepsilon) d^2 / 4$ then $(\mathrm{P})$ has a solution with high probability, while $(\mathrm{P})$ has no solutions with high probability if $n \geq (1 + \varepsilon) d^2 /4$. So far, only a trivial bound $n \geq d^2 / 2$ is known on the negative side, while the best results on the positive side assume $n \leq d^2 / \mathrm{polylog}(d)$. In this work, we improve over previous approaches using a key result of Bartl & Mendelson (2022) on the concentration of Gram matrices of random vectors under mild assumptions on their tail behavior. This allows us to give a simple proof that $(\mathrm{P})$ is feasible with high probability when $n \leq d^2 / C$, for a (possibly large) constant $C > 0$.
21.5OCAug 17, 2023
Hitting the High-Dimensional Notes: An ODE for SGD learning dynamics on GLMs and multi-index modelsElizabeth Collins-Woodfin, Courtney Paquette, Elliot Paquette et al.
We analyze the dynamics of streaming stochastic gradient descent (SGD) in the high-dimensional limit when applied to generalized linear models and multi-index models (e.g. logistic regression, phase retrieval) with general data-covariance. In particular, we demonstrate a deterministic equivalent of SGD in the form of a system of ordinary differential equations that describes a wide class of statistics, such as the risk and other measures of sub-optimality. This equivalence holds with overwhelming probability when the model parameter count grows proportionally to the number of data. This framework allows us to obtain learning rate thresholds for stability of SGD as well as convergence guarantees. In addition to the deterministic equivalent, we introduce an SDE with a simplified diffusion coefficient (homogenized SGD) which allows us to analyze the dynamics of general statistics of SGD iterates. Finally, we illustrate this theory on some standard examples and show numerical simulations which give an excellent match to the theory.
16.2OCJun 2, 2022
Trajectory of Mini-Batch Momentum: Batch Size Saturation and Convergence in High DimensionsKiwon Lee, Andrew N. Cheng, Courtney Paquette et al.
We analyze the dynamics of large batch stochastic gradient descent with momentum (SGD+M) on the least squares problem when both the number of samples and dimensions are large. In this setting, we show that the dynamics of SGD+M converge to a deterministic discrete Volterra equation as dimension increases, which we analyze. We identify a stability measurement, the implicit conditioning ratio (ICR), which regulates the ability of SGD+M to accelerate the algorithm. When the batch size exceeds this ICR, SGD+M converges linearly at a rate of $\mathcal{O}(1/\sqrtκ)$, matching optimal full-batch momentum (in particular performing as well as a full-batch but with a fraction of the size). For batch sizes smaller than the ICR, in contrast, SGD+M has rates that scale like a multiple of the single batch SGD rate. We give explicit choices for the learning rate and momentum parameter in terms of the Hessian spectra that achieve this performance.
8.3MLMar 15
Power-Law Spectrum of the Random Feature ModelElliot Paquette, Ke Liang Xiao, Yizhe Zhu
Scaling laws for neural networks, in which the loss decays as a power-law in the number of parameters, data, and compute, depend fundamentally on the spectral structure of the data covariance, with power-law eigenvalue decay appearing ubiquitously in vision and language tasks. A central question is whether this spectral structure is preserved or destroyed when data passes through the basic building block of a neural network: a random linear projection followed by a nonlinear activation. We study this question for the random feature model: given data $x \sim N(0,H)\in \mathbb{R}^v$ where $H$ has $α$-power-law spectrum ($λ_j(H ) \asymp j^{-α}$, $α> 1$), a Gaussian sketch matrix $W \in \mathbb{R}^{v\times d}$, and an entrywise monomial $f(y) = y^{p}$, we characterize the eigenvalues of the population random-feature covariance $\mathbb{E}_{x }[\frac{1}{d}f(W^\top x )^{\otimes 2}]$. We prove matching upper and lower bounds: for all $1 \leq j \leq c_1 d \log^{-(p+1)}(d)$, the $j$-th eigenvalue is of order $\left(\log^{p-1}(j+1)/j\right)^α$. For $ c_1 d \log^{-(p+1)}(d)\leq j\leq d$, the $j$-th eigenvalue is of order $j^{-α}$ up to a polylog factor. That is, the power-law exponent $α$ is inherited exactly from the input covariance, modified only by a logarithmic correction that depends on the monomial degree $p$. The proof combines a dyadic head-tail decomposition with Wick chaos expansions for higher-order monomials and random matrix concentration inequalities.
9.6MLMay 27
Dynamics of Stochastic Momentum with Sparse Updates in High DimensionsKatie Everett, Elliot Paquette
Existing theory of momentum assumes that gradients arrive at every parameter at a roughly constant rate, an assumption violated in practice by heavy-tailed data distributions and modern architectures. We theoretically analyze the dynamics of two tractable models of momentum under sparse updates: a least squares model with sparse inputs and a logistic regression model with a rare class. Both admit exact closed-form second-moment dynamics whose high-dimensional limits we characterize across three scaling exponents for sparsity, batch size, and momentum decay. The phase structure on both problems is governed by the ratio of two intrinsic timescales: a momentum retention timescale (how many active updates the buffer survives) and a learning timescale (how many active updates it takes to reduce the squared error). When learning is much slower than retention, the limit matches SGD; when learning is faster, the system is unstable; where the timescales coincide, we recover classical heavy-ball dynamics. The oscillatory dynamics occur at different momentum values for different token sparsity, creating a spectral conflict for global momentum across token frequencies.
32.8MLMay 23, 2024
4+3 Phases of Compute-Optimal Neural Scaling LawsElliot Paquette, Courtney Paquette, Lechao Xiao et al.
We consider the solvable neural scaling model with three parameters: data complexity, target complexity, and model-parameter-count. We use this neural scaling model to derive new predictions about the compute-limited, infinite-data scaling law regime. To train the neural scaling model, we run one-pass stochastic gradient descent on a mean-squared loss. We derive a representation of the loss curves which holds over all iteration counts and improves in accuracy as the model parameter count grows. We then analyze the compute-optimal model-parameter-count, and identify 4 phases (+3 subphases) in the data-complexity/target-complexity phase-plane. The phase boundaries are determined by the relative importance of model capacity, optimizer noise, and embedding of the features. We furthermore derive, with mathematical proof and extensive numerical evidence, the scaling-law exponents in all of these phases, in particular computing the optimal model-parameter-count as a function of floating point operation budget.
4.1LGOct 19, 2025
High-Dimensional Privacy-Utility Dynamics of Noisy Stochastic Gradient Descent on Least SquaresShurong Lin, Eric D. Kolaczyk, Adam Smith et al.
The interplay between optimization and privacy has become a central theme in privacy-preserving machine learning. Noisy stochastic gradient descent (SGD) has emerged as a cornerstone algorithm, particularly in large-scale settings. These variants of gradient methods inject carefully calibrated noise into each update to achieve differential privacy, the gold standard notion of rigorous privacy guarantees. Prior work primarily provides various bounds on statistical risk and privacy loss for noisy SGD, yet the \textit{exact} behavior of the process remains unclear, particularly in high-dimensional settings. This work leverages a diffusion approach to analyze noisy SGD precisely, providing a continuous-time perspective that captures both statistical risk evolution and privacy loss dynamics in high dimensions. Moreover, we study a variant of noisy SGD that does not require explicit knowledge of gradient sensitivity, unlike existing work that assumes or enforces sensitivity through gradient clipping. Specifically, we focus on the least squares problem with $\ell_2$ regularization.
14.3OCJun 7, 2021
Dynamics of Stochastic Momentum Methods on Large-scale, Quadratic ModelsCourtney Paquette, Elliot Paquette
We analyze a class of stochastic gradient algorithms with momentum on a high-dimensional random least squares problem. Our framework, inspired by random matrix theory, provides an exact (deterministic) characterization for the sequence of loss values produced by these algorithms which is expressed only in terms of the eigenvalues of the Hessian. This leads to simple expressions for nearly-optimal hyperparameters, a description of the limiting neighborhood, and average-case complexity. As a consequence, we show that (small-batch) stochastic heavy-ball momentum with a fixed momentum parameter provides no actual performance improvement over SGD when step sizes are adjusted correctly. For contrast, in the non-strongly convex setting, it is possible to get a large improvement over SGD using momentum. By introducing hyperparameters that depend on the number of samples, we propose a new algorithm sDANA (stochastic dimension adjusted Nesterov acceleration) which obtains an asymptotically optimal average-case complexity while remaining linearly convergent in the strongly convex setting without adjusting parameters.
21.8OCFeb 8, 2021
SGD in the Large: Average-case Analysis, Asymptotics, and Stepsize CriticalityCourtney Paquette, Kiwon Lee, Fabian Pedregosa et al.
We propose a new framework, inspired by random matrix theory, for analyzing the dynamics of stochastic gradient descent (SGD) when both number of samples and dimensions are large. This framework applies to any fixed stepsize and the finite sum setting. Using this new framework, we show that the dynamics of SGD on a least squares problem with random data become deterministic in the large sample and dimensional limit. Furthermore, the limiting dynamics are governed by a Volterra integral equation. This model predicts that SGD undergoes a phase transition at an explicitly given critical stepsize that ultimately affects its convergence rate, which we also verify experimentally. Finally, when input data is isotropic, we provide explicit expressions for the dynamics and average-case convergence rates (i.e., the complexity of an algorithm averaged over all possible inputs). These rates show significant improvement over the worst-case complexities.
13.8OCJun 8, 2020
Halting Time is Predictable for Large Models: A Universality Property and Average-case AnalysisCourtney Paquette, Bart van Merriënboer, Elliot Paquette et al.
Average-case analysis computes the complexity of an algorithm averaged over all possible inputs. Compared to worst-case analysis, it is more representative of the typical behavior of an algorithm, but remains largely unexplored in optimization. One difficulty is that the analysis can depend on the probability distribution of the inputs to the model. However, we show that this is not the case for a class of large-scale problems trained with first-order methods including random least squares and one-hidden layer neural networks with random weights. In fact, the halting time exhibits a universality property: it is independent of the probability distribution. With this barrier for average-case analysis removed, we provide the first explicit average-case convergence rates showing a tighter complexity not captured by traditional worst-case analysis. Finally, numerical simulations suggest this universality property holds for a more general class of algorithms and problems.