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The Transformer architecture has revolutionized the field of sequence modeling and underpins the recent breakthroughs in large language models (LLMs). However, a comprehensive mathematical theory that explains its structure and operations…

Machine Learning · Computer Science 2026-04-14 Xue-Cheng Tai , Hao Liu , Lingfeng Li , Raymond H. Chan

Transformer based language models exhibit intelligent behaviors such as understanding natural language, recognizing patterns, acquiring knowledge, reasoning, planning, reflecting and using tools. This paper explores how their underlying…

Machine Learning · Computer Science 2023-11-15 Sumeet S. Singh

The Transformer architecture has inarguably revolutionized deep learning, overtaking classical architectures like multi-layer perceptrons (MLPs) and convolutional neural networks (CNNs). At its core, the attention block differs in form and…

Machine Learning · Computer Science 2025-03-18 Weronika Ormaniec , Felix Dangel , Sidak Pal Singh

The Transformer architecture has achieved tremendous success in natural language processing, computer vision, and scientific computing through its self-attention mechanism. However, its core components-positional encoding and attention…

Machine Learning · Computer Science 2025-11-13 Xianshuai Shi , Jianfeng Zhu , Leibo Liu

Transformers have become the foundational architecture for a broad spectrum of sequence modeling applications, underpinning state-of-the-art systems in natural language processing, vision, and beyond. However, their theoretical limitations…

Computation and Language · Computer Science 2026-02-13 Michelle Yuan , Weiyi Sun , Amir H. Rezaeian , Jyotika Singh , Sandip Ghoshal , Yao-Ting Wang , Miguel Ballesteros , Yassine Benajiba

The self-attention mechanism, a cornerstone of Transformer-based state-of-the-art deep learning architectures, is largely heuristic-driven and fundamentally challenging to interpret. Establishing a robust theoretical foundation to explain…

Computer Vision and Pattern Recognition · Computer Science 2026-02-10 Laziz U. Abdullaev , Maksim Tkachenko , Tan M. Nguyen

The Transformer architecture has revolutionized artificial intelligence, yet a principled theoretical understanding of its internal mechanisms remains elusive. This paper introduces a novel analytical framework that reconceptualizes the…

Machine Learning · Computer Science 2025-09-30 Yukun Zhang , Xueqing Zhou

Transformers have significantly advanced the field of natural language processing, but comprehending their internal mechanisms remains a challenge. In this paper, we introduce a novel geometric perspective that elucidates the inner…

Computation and Language · Computer Science 2023-09-20 Raul Molina

Transformers are widely used to extract semantic meanings from input tokens, yet they usually operate as black-box models. In this paper, we present a simple yet informative decomposition of hidden states (or embeddings) of trained…

Machine Learning · Computer Science 2024-02-06 Jiajun Song , Yiqiao Zhong

A recent body of work has demonstrated that Transformer embeddings can be linearly decomposed into well-defined sums of factors, that can in turn be related to specific network inputs or components. There is however still a dearth of work…

Computation and Language · Computer Science 2023-10-12 Timothee Mickus , Raúl Vázquez

Despite the popularity of transformers in practice, their architectures are empirically designed and neither mathematically justified nor interpretable. Moreover, as indicated by many empirical studies, some components of transformer…

Machine Learning · Computer Science 2025-06-05 Peng Wang , Yifu Lu , Yaodong Yu , Druv Pai , Qing Qu , Yi Ma

Pre-trained large foundation models play a central role in the recent surge of artificial intelligence, resulting in fine-tuned models with remarkable abilities when measured on benchmark datasets, standard exams, and applications. Due to…

Computer Vision and Pattern Recognition · Computer Science 2024-01-30 Shaeke Salman , Md Montasir Bin Shams , Xiuwen Liu

Scientific applications increasingly demand real-time surrogate models that can capture the behavior of strongly coupled multiphysics systems driven by multiple input functions, such as in thermo-mechanical and electro-thermal processes.…

Machine Learning · Computer Science 2025-07-08 Kazuma Kobayashi , Jaewan Park , Qibang Liu , Seid Koric , Diab Abueidda , Syed Bahauddin Alam

While the properties of materials at microscopic scales are well described by fundamental quantum mechanical equations and electronic structure theories, the emergent behavior of mesoscopic or macroscopic composites is no longer governed…

Applied Physics · Physics 2025-07-10 Lifeng Hao , Fan Li , Yongqi Li , Siyong Wang , Xiaodong He

Despite their central role in the success of foundational models and large-scale language modeling, the theoretical foundations governing the operation of Transformers remain only partially understood. Contemporary research has largely…

Machine Learning · Computer Science 2025-06-02 Sagar Ghosh , Kushal Bose , Swagatam Das

Transformer architecture has widespread applications, particularly in Natural Language Processing and computer vision. Recently Transformers have been employed in various aspects of time-series analysis. This tutorial provides an overview…

Machine Learning · Computer Science 2023-07-27 Sabeen Ahmed , Ian E. Nielsen , Aakash Tripathi , Shamoon Siddiqui , Ghulam Rasool , Ravi P. Ramachandran

Understanding Transformer-based models has attracted significant attention, as they lie at the heart of recent technological advances across machine learning. While most interpretability methods rely on running models over inputs, recent…

Computation and Language · Computer Science 2023-12-27 Guy Dar , Mor Geva , Ankit Gupta , Jonathan Berant

While the successes of transformers across many domains are indisputable, accurate understanding of the learning mechanics is still largely lacking. Their capabilities have been probed on benchmarks which include a variety of structured and…

Machine Learning · Computer Science 2023-07-25 Yuchen Li , Yuanzhi Li , Andrej Risteski

Integrating machine learning into the internals of database management systems requires significant feature engineering, a human effort-intensive process to determine the best way to represent the pieces of information that are relevant to…

Databases · Computer Science 2019-02-04 Ryan Marcus , Olga Papaemmanouil

We explore a wider theoretical framework that has quantum field theory built-in, taking the fact that quantum mechanics is reconstructed from quantum field theory as a hint. We formulate a quantum theory with an embedded structure by…

High Energy Physics - Theory · Physics 2025-02-13 Yoshiharu Kawamura
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