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High Energy Physics (HEP) experiments like BESIII produce petabyte-scale data. Extracting physics results requires complex workflows (simulation, reconstruction, statistical analysis, etc.) that traditionally take experts months or years.…

Understanding elementary mechanisms behind solid-state phase transformations and reactions is the key to optimizing desired functional properties of many technologically relevant materials. Recent advances in scanning transmission electron…

Human parsing is a key topic in image processing with many applications, such as surveillance analysis, human-robot interaction, person search, and clothing category classification, among many others. Recently, due to the success of deep…

Computer Vision and Pattern Recognition · Computer Science 2023-01-31 Xiaomei Zhang , Xiangyu Zhu , Ming Tang , Zhen Lei

We propose an approach to symbolic regression based on a novel variational autoencoder for generating hierarchical structures, HVAE. It combines simple atomic units with shared weights to recursively encode and decode the individual nodes…

Machine Learning · Computer Science 2023-09-12 Sebastian Mežnar , Sašo Džeroski , Ljupčo Todorovski

Recent advancements in abilities to create and manipulate the electron's transverse wave function within the transmission electron microscope (TEM) and scanning TEM (STEM) have enabled vectorially-resolved electron energy loss (EEL) and…

Mesoscale and Nanoscale Physics · Physics 2024-03-12 Austin G. Nixon , Matthieu Chalifour , Marc R. Bourgeois , Michael Sanchez , David J. Masiello

The rapid advancement of Large Language Models (LLMs) has brought a pressing challenge: how to reliably assess hallucinations to guarantee model trustworthiness. Although Automatic Hallucination Evaluation (AHE) has become an indispensable…

Computation and Language · Computer Science 2025-10-22 Siya Qi , Lin Gui , Yulan He , Zheng Yuan

We present Experiment Automation Agents (EAA), a vision-language-model-driven agentic system designed to automate complex experimental microscopy workflows. EAA integrates multimodal reasoning, tool-augmented action, and optional long-term…

Artificial Intelligence · Computer Science 2026-02-18 Ming Du , Yanqi Luo , Srutarshi Banerjee , Michael Wojcik , Jelena Popovic , Mathew J. Cherukara

A new semi-supervised machine learning method for the discovery of structure-spectrum relationships is developed and demonstrated using the specific example of interpreting X-ray absorption near-edge structure (XANES) spectra. This method…

Materials Science · Physics 2023-05-17 Zhu Liang , Matthew R. Carbone , Wei Chen , Fanchen Meng , Eli Stavitski , Deyu Lu , Mark S. Hybertsen , Xiaohui Qu

Three-dimensional electron diffraction (3D ED) has emerged as a powerful method for solving the structures of sub-micron-sized particles down to nanoparticles. However, it faces technical challenges when applied to beam-sensitive samples or…

The acquisition of a hyperspectral image is nowadays a standard technique used in the scanning transmission electron microscope. It relates the spatial position of the electron probe to the spectral data associated with it. In the case of…

The structures, as building-blocks for designing functional nanomaterials, have fueled the development of versatile nanoprobes to understand local structures of noncrystalline specimens. Progresses in analyzing structures of individual…

Sparse autoencoders (SAEs) are a popular tool for interpreting large language model activations, but their utility in addressing open questions in interpretability remains unclear. In this work, we demonstrate their effectiveness by using…

Machine Learning · Computer Science 2025-04-21 Dmitrii Kharlapenko , Stepan Shabalin , Fazl Barez , Arthur Conmy , Neel Nanda

The ruling method in modern Artificial Intelligence spanning from Deep Reinforcement Learning (DRL) to Large Language Models (LLMs) relies on a surge of static, externally defined reward functions. While this "extrinsic maximization"…

Machine Learning · Computer Science 2025-12-30 Dhruv Tiwari

Modern AI algorithms require labeled data. In real world, majority of data are unlabeled. Labeling the data are costly. this is particularly true for some areas requiring special skills, such as reading radiology images by physicians. To…

Machine Learning · Statistics 2026-03-31 Yiran Huang , Jian-Feng Yang , Haoda Fu

Aberration-corrected environmental transmission electron microscopy (ETEM) enables atomic-resolution imaging of dynamic catalytic processes. Correlating atomic-scale structural changes with reaction products detected by mass spectrometry…

High energy electron beams can now be routinely focused to 1-2 {\AA} and offer the ability to obtain vibrational information from materials using monochromated electron energy-loss spectroscopy (EELS) in a scanning transmission electron…

Materials Science · Physics 2021-07-13 Kartik Venkatraman , Peter A. Crozier

Electron energy loss spectroscopy is consolidating as a powerful tool to explore electronic (as well as vibrational) excitations of matter, including molecules. Performed in a scanning transmission electron microscope, this technique is…

Chemical Physics · Physics 2021-03-05 Ciro A. Guido , Enzo Rotunno , Matteo Zanfrognini , Stefano Corni , Vincenzo Grillo

An electroencephalogram (EEG) records the spatially averaged electrical activity of neurons in the brain, measured from the human scalp. Prior studies have explored EEG-based classification of objects or concepts, often for passive viewing…

Machine Learning · Computer Science 2026-02-25 Anupam Sharma , Harish Katti , Prajwal Singh , Shanmuganathan Raman , Krishna Miyapuram

Self-driving laboratories or autonomous experimentation are emerging as transformative platforms for accelerating scientific discovery. Bayesian optimization (BO) is among the most widely used machine learning frameworks for these purposes,…

Hidden Markov models (HMMs) are widely used statistical models for modeling sequential data. The parameter estimation for HMMs from time series data is an important learning problem. The predominant methods for parameter estimation are…

Machine Learning · Computer Science 2014-04-30 Carl Mattfeld