Generative Unfolding with Distribution Mapping

Machine learning enables unbinned, highly-differential cross section measurements. A recent idea uses generative models to morph a starting simulation into the unfolded data. We show how to extend two morphing techniques, Schr\"odinger Bridges and Direct Diffusion, in order to ensure that the models learn the correct conditional probabilities. This brings distribution mapping to a similar level of accuracy as the state-of-the-art conditional generative unfolding methods. Numerical results are presented with a standard benchmark dataset of single jet substructure as well as for a new dataset describing a 22-dimensional phase space of Z + 2-jets.

A Lorentz-Equivariant Transformer for All of the LHC

We show that the Lorentz-Equivariant Geometric Algebra Transformer (L-GATr) yields state-of-the-art performance for a wide range of machine learning tasks at the Large Hadron Collider. L-GATr represents data in a geometric algebra over space-time and is equivariant under Lorentz transformations. The underlying architecture is a versatile and scalable transformer, which is able to break symmetries if needed. We demonstrate the power of L-GATr for amplitude regression and jet classification, and then benchmark it as the first Lorentz-equivariant generative network. For all three LHC tasks, we find significant improvements over previous architectures.

CaloChallenge 2022: A Community Challenge for Fast Calorimeter Simulation

We present the results of the "Fast Calorimeter Simulation Challenge 2022" - the CaloChallenge. We study state-of-the-art generative models on four calorimeter shower datasets of increasing dimensionality, ranging from a few hundred voxels to a few tens of thousand voxels. The 31 individual submissions span a wide range of current popular generative architectures, including Variational AutoEncoders (VAEs), Generative Adversarial Networks (GANs), Normalizing Flows, Diffusion models, and models based on Conditional Flow Matching. We compare all submissions in terms of quality of generated calorimeter showers, as well as shower generation time and model size. To assess the quality we use a broad range of different metrics including differences in 1-dimensional histograms of observables, KPD/FPD scores, AUCs of binary classifiers, and the log-posterior of a multiclass classifier. The results of the CaloChallenge provide the most complete and comprehensive survey of cutting-edge approaches to calorimeter fast simulation to date. In addition, our work provides a uniquely detailed perspective on the important problem of how to evaluate generative models. As such, the results presented here should be applicable for other domains that use generative AI and require fast and faithful generation of samples in a large phase space.

Constraining the Higgs Potential with Neural Simulation-based Inference for Di-Higgs Production

Determining the form of the Higgs potential is one of the most exciting challenges of modern particle physics. Higgs pair production directly probes the Higgs self-coupling and should be observed in the near future at the High-Luminosity LHC. We explore how to improve the sensitivity to physics beyond the Standard Model through per-event kinematics for di-Higgs events. In particular, we employ machine learning through simulation-based inference to estimate per-event likelihood ratios and gauge potential sensitivity gains from including this kinematic information. In terms of the Standard Model Effective Field Theory, we find that adding a limited number of observables can help to remove degeneracies in Wilson coefficient likelihoods and significantly improve the experimental sensitivity.

Lorentz-Equivariant Geometric Algebra Transformers for High-Energy Physics

Extracting scientific understanding from particle-physics experiments requires solving diverse learning problems with high precision and good data efficiency. We propose the Lorentz Geometric Algebra Transformer (L-GATr), a new multi-purpose architecture for high-energy physics. L-GATr represents high-energy data in a geometric algebra over four-dimensional space-time and is equivariant under Lorentz transformations, the symmetry group of relativistic kinematics. At the same time, the architecture is a Transformer, which makes it versatile and scalable to large systems. L-GATr is first demonstrated on regression and classification tasks from particle physics. We then construct the first Lorentz-equivariant generative model: a continuous normalizing flow based on an L-GATr network, trained with Riemannian flow matching. Across our experiments, L-GATr is on par with or outperforms strong domain-specific baselines.

The Landscape of Unfolding with Machine Learning

Recent innovations from machine learning allow for data unfolding, without binning and including correlations across many dimensions. We describe a set of known, upgraded, and new methods for ML-based unfolding. The performance of these approaches are evaluated on the same two datasets. We find that all techniques are capable of accurately reproducing the particle-level spectra across complex observables. Given that these approaches are conceptually diverse, they offer an exciting toolkit for a new class of measurements that can probe the Standard Model with an unprecedented level of detail and may enable sensitivity to new phenomena.

Anomalies, Representations, and Self-Supervision

We develop a self-supervised method for density-based anomaly detection using contrastive learning, and test it using event-level anomaly data from CMS ADC2021. The AnomalyCLR technique is data-driven and uses augmentations of the background data to mimic non-Standard-Model events in a model-agnostic way. It uses a permutation-invariant Transformer Encoder architecture to map the objects measured in a collider event to the representation space, where the data augmentations define a representation space which is sensitive to potential anomalous features. An AutoEncoder trained on background representations then computes anomaly scores for a variety of signals in the representation space. With AnomalyCLR we find significant improvements on performance metrics for all signals when compared to the raw data baseline.

Generative Networks for Precision Enthusiasts

Generative networks are opening new avenues in fast event generation for the LHC. We show how generative flow networks can reach percent-level precision for kinematic distributions, how they can be trained jointly with a discriminator, and how this discriminator improves the generation. Our joint training relies on a novel coupling of the two networks which does not require a Nash equilibrium. We then estimate the generation uncertainties through a Bayesian network setup and through conditional data augmentation, while the discriminator ensures that there are no systematic inconsistencies compared to the training data.

Shared Data and Algorithms for Deep Learning in Fundamental Physics

We introduce a collection of datasets from fundamental physics research -- including particle physics, astroparticle physics, and hadron- and nuclear physics -- for supervised machine learning studies. These datasets, containing hadronic top quarks, cosmic-ray induced air showers, phase transitions in hadronic matter, and generator-level histories, are made public to simplify future work on cross-disciplinary machine learning and transfer learning in fundamental physics. Based on these data, we present a simple yet flexible graph-based neural network architecture that can easily be applied to a wide range of supervised learning tasks in these domains. We show that our approach reaches performance close to state-of-the-art dedicated methods on all datasets. To simplify adaptation for various problems, we provide easy-to-follow instructions on how graph-based representations of data structures, relevant for fundamental physics, can be constructed and provide code implementations for several of them. Implementations are also provided for our proposed method and all reference algorithms.

Better Latent Spaces for Better Autoencoders

Autoencoders as tools behind anomaly searches at the LHC have the structural problem that they only work in one direction, extracting jets with higher complexity but not the other way around. To address this, we derive classifiers from the latent space of (variational) autoencoders, specifically in Gaussian mixture and Dirichlet latent spaces. In particular, the Dirichlet setup solves the problem and improves both the performance and the interpretability of the networks.