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In this short paper, a neural network that is able to form a low dimensional topological hidden representation is explained. The neural network can be trained as an autoencoder, a classifier or mix of both, and produces different low…

Machine Learning · Computer Science 2020-06-16 Pitoyo Hartono

Even though neural networks enjoy widespread use, they still struggle to learn the basic laws of physics. How might we endow them with better inductive biases? In this paper, we draw inspiration from Hamiltonian mechanics to train models…

Neural and Evolutionary Computing · Computer Science 2019-09-06 Sam Greydanus , Misko Dzamba , Jason Yosinski

We revisit the classic signal-to-symbol barrier in light of the remarkable ability of deep neural networks to generate realistic synthetic data. DeepFakes and spoofing highlight the feebleness of the link between physical reality and its…

Machine Learning · Computer Science 2022-08-05 Alessandro Achille , Stefano Soatto

Tensor networks (TN) have found a wide use in machine learning, and in particular, TN and deep learning bear striking similarities. In this work, we propose the quantum-classical hybrid tensor networks (HTN) which combine tensor networks…

Machine Learning · Computer Science 2024-08-15 Ding Liu , Jiaqi Yao , Zekun Yao , Quan Zhang

The learnability of different neural architectures can be characterized directly by computable measures of data complexity. In this paper, we reframe the problem of architecture selection as understanding how data determines the most…

Machine Learning · Computer Science 2018-02-14 William H. Guss , Ruslan Salakhutdinov

We study the computational complexity of (deterministic or randomized) algorithms based on point samples for approximating or integrating functions that can be well approximated by neural networks. Such algorithms (most prominently…

Machine Learning · Computer Science 2021-04-08 Philipp Grohs , Felix Voigtlaender

Statistical learning methods show great promise in providing an accurate prediction of materials and molecular properties, while minimizing the need for computationally demanding electronic structure calculations. The accuracy and…

Materials Science · Physics 2018-01-24 Andrea Grisafi , David M. Wilkins , Gábor Csányi , Michele Ceriotti

Convolutional neural networks (CNNs) have gained widespread usage across various fields such as weather forecasting, computer vision, autonomous driving, and medical image analysis due to its exceptional ability to extract spatial…

Computer Vision and Pattern Recognition · Computer Science 2024-05-21 Alifu Xiafukaiti , Devanshu Garg , Aruto Hosaka , Koichi Yanagisawa , Yuichiro Minato , Tsuyoshi Yoshida

Deep neural networks have achieved great success in the last decade. When designing neural networks to handle the ubiquitous geometric data such as point clouds and graphs, it is critical that the model can maintain invariance towards…

Computer Vision and Pattern Recognition · Computer Science 2025-10-28 Ziwei Zhang , Xin Wang , Zeyang Zhang , Peng Cui , Wenwu Zhu

Tensorizing a neural network involves reshaping some or all of its dense weight matrices into higher-order tensors and approximating them using low-rank tensor network decompositions. This technique has shown promise as a model compression…

Machine Learning · Computer Science 2025-05-27 Safa Hamreras , Sukhbinder Singh , Román Orús

Convolutional neural networks (CNNs) have been established as the main workhorse in image data processing; nonetheless, they require large amounts of data to train, often produce overconfident predictions, and frequently lack the ability to…

Computer Vision and Pattern Recognition · Computer Science 2025-10-14 Sarah Harkins Dayton , Hayden Everett , Ioannis Schizas , David L. Boothe , Vasileios Maroulas

Machine Learning facilitates building a large variety of models, starting from elementary linear regression models to very complex neural networks. Neural networks are currently limited by the size of data provided and the huge…

Materials Science · Physics 2023-08-25 Ruman Moulik , Ankita Phutela , Sajjan Sheoran , Saswata Bhattacharya

Machine learning techniques have been shown to be effective to recognize different phases of matter and produce phase diagrams in the parameter space interested, while they usually require prior labeled data to perform well. Here, we…

Machine learning has emerged as a promising approach to study the properties of many-body systems. Recently proposed as a tool to classify phases of matter, the approach relies on classical simulation methods$-$such as Monte Carlo$-$which…

Quantum Physics · Physics 2020-07-17 Alexey Uvarov , Andrey Kardashin , Jacob Biamonte

Topology optimization is computationally demanding that requires the assembly and solution to a finite element problem for each material distribution hypothesis. As a complementary alternative to the traditional physics-based topology…

Machine Learning · Computer Science 2018-08-23 Saurabh Banga , Harsh Gehani , Sanket Bhilare , Sagar Patel , Levent Kara

Deep neural networks have achieved remarkable success, yet our understanding of how they learn remains limited. These models can learn high-dimensional tasks, which is generally statistically intractable due to the curse of dimensionality.…

Machine Learning · Computer Science 2025-10-08 Alessandro Favero

Embedding molecular symmetries into machine-learning models is key for efficient learning of chemico-physical scalar properties, but little evidence on how to extend the same strategy to tensorial quantities exists. Here we formulate a…

Materials Science · Physics 2022-04-27 Vu Ha Anh Nguyen , Alessandro Lunghi

Decades of psychological research have been aimed at modeling how people learn features and categories. The empirical validation of these theories is often based on artificial stimuli with simple representations. Recently, deep neural…

Computer Vision and Pattern Recognition · Computer Science 2018-07-25 Joshua C. Peterson , Joshua T. Abbott , Thomas L. Griffiths

In certain classes of physical quantum systems, the exponentially large state space "fragments" into many low-dimensional, dynamically disconnected subspaces. We introduce a learning problem known as fragment classification, where given a…

Quantum Physics · Physics 2026-05-08 Mikhail Mints , Eric R. Anschuetz

Machine learning has emerged as a powerful approach in materials discovery. Its major challenge is selecting features that create interpretable representations of materials, useful across multiple prediction tasks. We introduce an…

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