← Search

Peter Orbanz

9 accepted papers

2026

A Single Architecture for Representing Invariance Under Any Space Group

ICLR 2026poster

Incorporating known symmetries in data into machine learning models has consistently improved predictive accuracy, robustness, and generalization. However, achieving exact invariance to specific symmetries typically requires designing bespoke architectures for each group of symmetries, limiting scal…

Cited by 0SourceScholar
2025

Designing Mechanical Meta-Materials by Learning Equivariant Flows

ICLR 2025poster

Mechanical meta-materials are solids whose geometric structure results in exotic nonlinear behaviors that are not typically achievable via homogeneous materials. We show how to drastically expand the design space of a class of mechanical meta-materials known as $\textit{cellular solids}$, by general…

Cited by 0SourcePDFScholar
2025

Diagonal Symmetrization of Neural Network Solvers for the Many-Electron Schrödinger Equation

ICML 2025poster

Incorporating group symmetries into neural networks has been a cornerstone of success in many AI-for-science applications. Diagonal groups of isometries, which describe the invariance under a simultaneous movement of multiple objects, arise naturally in many-body quantum problems. Despite their impo…

Cited by 0SourcePDFScholar
2025

Distinguishing Cause from Effect with Causal Velocity Models

ICML 2025poster

Bivariate structural causal models (SCM) are often used to infer causal direction by examining their goodness-of-fit under restricted model classes. In this paper, we describe a parametrization of bivariate SCMs in terms of a *causal velocity* by viewing the cause variable as time in a dynamical sys…

2025

Efficiently Vectorized MCMC on Modern Accelerators

ICML 2025spotlight

With the advent of automatic vectorization tools (e.g., JAX's vmap), writing multi-chain MCMC algorithms is often now as simple as invoking those tools on single-chain code. Whilst convenient, for various MCMC algorithms this results in a synchronization problem---loosely speaking, at each iteration…

2023

The Graph Pencil Method: Mapping Subgraph Densities to Stochastic Block Models

NeurIPS 2023poster

In this work, we describe a method that determines an exact map from a finite set of subgraph densities to the parameters of a stochastic block model (SBM) matching these densities. Given a number K of blocks, the subgraph densities of a finite number of stars and bistars uniquely determines a singl…

Cited by 3SourcePDFScholar
2019

Empirical Risk Minimization and Stochastic Gradient Descent for Relational Data

AISTATS 2019poster

Empirical risk minimization is the main tool for prediction problems, but its extension to relational data remains unsolved. We solve this problem using recent ideas from graph sampling theory to (i) define an empirical risk for relational data and (ii) obtain stochastic gradients for this empirical…

2019

Non-vacuous Generalization Bounds at the ImageNet Scale: a PAC-Bayesian Compression Approach

ICLR 2019poster

Modern neural networks are highly overparameterized, with capacity to substantially overfit to training data. Nevertheless, these networks often generalize well in practice. It has also been observed that trained networks can often be ``compressed to much smaller representations. The purpose of this…