Tilman Plehn

Barry M. Dillon, Luigi Favaro, Friedrich Feiden et al.

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.

Johann Brehmer, Víctor Bresó, Pim de Haan et al.

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.

Claudius Krause, Michele Faucci Giannelli, Gregor Kasieczka et al.

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.

Jonas Spinner, Victor Bresó, Pim de Haan et al.

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.

Nathan Huetsch, Javier Mariño Villadamigo, Alexander Shmakov et al.

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.

Anja Butter, Sascha Diefenbacher, Nathan Huetsch et al.

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, Schrödinger 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.

Anja Butter, François Charton, Javier Mariño Villadamigo et al.

Generative networks are an exciting tool for fast LHC event generation. Usually, they are used to generate configurations with a fixed number of particles. Autoregressive transformers allow us to generate events with variable numbers of particles, very much in line with the physics of QCD jet radiation. We show how they can learn a factorized likelihood for jet radiation and extrapolate in terms of the number of generated jets. For this extrapolation, bootstrapping training data and training with modifications of the likelihood loss can be used.

Anja Butter, Theo Heimel, Nathan Huetsch et al.

Machine learning allows unfolding high-dimensional spaces without binning at the LHC. The new SPINUP method extracts the unfolded distribution based on a neural network encoding the forward mapping, making it independent of the prior from the simulated training data. It is made efficient through neural importance sampling, and ensembling can be used to estimate the effect of information loss in the forward process. We showcase SPINUP for unfolding detector effects on jet substructure observables and for unfolding to parton level of associated Higgs and single-top production.

Henning Bahl, Sascha Diefenbacher, Nina Elmer et al.

Generative networks are perfect tools to enhance the speed and precision of LHC simulations. It is important to understand their statistical precision, especially when generating events beyond the size of the training dataset. We present two complementary methods to estimate the amplification factor without large holdout datasets. Averaging amplification uses Bayesian networks or ensembling to estimate amplification from the precision of integrals over given phase-space volumes. Differential amplification uses hypothesis testing to quantify amplification without any resolution loss. Applied to state-of-the-art event generators, both methods indicate that amplification is possible in specific regions of phase space, but not yet across the entire distribution.

Anja Butter, Theo Heimel, Sander Hummerich et al.

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.

Lisa Benato, Erik Buhmann, Martin Erdmann et al.

We introduce a Python package that provides simply and unified access to a collection of datasets from fundamental physics research - including particle physics, astroparticle physics, and hadron- and nuclear physics - for supervised machine learning studies. The datasets contain hadronic top quarks, cosmic-ray induced air showers, phase transitions in hadronic matter, and generator-level histories. While public datasets from multiple fundamental physics disciplines already exist, the common interface and provided reference models simplify future work on cross-disciplinary machine learning and transfer learning in fundamental physics. We discuss the design and structure and line out how additional datasets can be submitted for inclusion. As showcase application, we present a simple yet flexible graph-based neural network architecture that can easily be applied to a wide range of supervised learning tasks. We show that our approach reaches performance close to 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.

Barry M. Dillon, Tilman Plehn, Christof Sauer et al.

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.

Marco Bellagente, Manuel Haußmann, Michel Luchmann et al.

Following the growing success of generative neural networks in LHC simulations, the crucial question is how to control the networks and assign uncertainties to their event output. We show how Bayesian normalizing flow or invertible networks capture uncertainties from the training and turn them into an uncertainty on the event weight. Fundamentally, the interplay between density and uncertainty estimates indicates that these networks learn functions in analogy to parameter fits rather than binned event counts.

Anja Butter, Sascha Diefenbacher, Gregor Kasieczka et al.

A critical question concerning generative networks applied to event generation in particle physics is if the generated events add statistical precision beyond the training sample. We show for a simple example with increasing dimensionality how generative networks indeed amplify the training statistics. We quantify their impact through an amplification factor or equivalent numbers of sampled events.

Marco Bellagente, Anja Butter, Gregor Kasieczka et al.

LHC analyses directly comparing data and simulated events bear the danger of using first-principle predictions only as a black-box part of event simulation. We show how simulations, for instance, of detector effects can instead be inverted using generative networks. This allows us to reconstruct parton level information from measured events. Our results illustrate how, in general, fully conditional generative networks can statistically invert Monte Carlo simulations. As a technical by-product we show how a maximum mean discrepancy loss can be staggered or cooled.