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This chapter provides a tutorial overview of first principles methods to describe the properties of matter at the ground state or equilibrium. It begins with a brief introduction to quantum and statistical mechanics for predicting the…

Computational Engineering, Finance, and Science · Computer Science 2020-10-14 Jianzhong Wu , Mengyang Gu

A computer simulation has to be fast to be helpful, if it is employed to study the behavior of a multicomponent dynamic system. This paper discusses modeling concepts and algorithmic techniques useful for creating such fast simulations.…

Data Structures and Algorithms · Computer Science 2007-05-23 Boris D. Lubachevsky

We present a theory for simultaneous approximation of the score function and its derivatives, enabling the handling of data distributions with low-dimensional structure and unbounded support. Our approximation error bounds match those in…

Numerical Analysis · Mathematics 2025-12-30 Konstantin Yakovlev , Nikita Puchkin

We study the approximation of functions which are invariant with respect to certain permutations of the input indices using flow maps of dynamical systems. Such invariant functions includes the much studied translation-invariant ones…

Machine Learning · Computer Science 2022-08-19 Qianxiao Li , Ting Lin , Zuowei Shen

In this paper, we develop a framework for path-planning on abstractions that are not provided to the agent a priori but instead emerge as a function of the available computational resources. We show how a path-planning problem in an…

Robotics · Computer Science 2021-07-29 Daniel T. Larsson , Dipankar Maity , Panagiotis Tsiotras

In this article, we consider a simple representation for real numbers and propose top-down procedures to approximate various algebraic and transcendental operations with arbitrary precision. Detailed algorithms and proofs are provided to…

Numerical Analysis · Computer Science 2015-09-22 Sarmen Keshishzadeh , Jan Friso Groote

We resolve a long-standing open question, about the existence of a constant-factor approximation algorithm for the average-case \textsc{Decision Tree} problem with uniform probability distribution over the hypotheses. We answer the question…

Data Structures and Algorithms · Computer Science 2026-04-29 Michał Szyfelbein

The AAA algorithm for rational approximation is employed to illustrate applications of rational functions all across numerical analysis.

Numerical Analysis · Mathematics 2025-10-21 Yuji Nakatsukasa , Lloyd N. Trefethen

We study the use of Temporal-Difference learning for estimating the structural parameters in dynamic discrete choice models. Our algorithms are based on the conditional choice probability approach but use functional approximations to…

Econometrics · Economics 2022-12-23 Karun Adusumilli , Dita Eckardt

We obtain estimates in simultaneous approximation for a summation-integral type genuine hybrid operator. The convergence of derivatives of operator to the corresponding derivatives of the functions is proved and estimates for rate of…

Classical Analysis and ODEs · Mathematics 2026-05-28 Asha Ram Gairola , Nidhi Bisht

This paper presents a method for computing eigenvalues and eigenvectors for some types of nonlinear eigenvalue problems. The main idea is to approximate the functions involved in the eigenvalue problem by rational functions and then apply a…

Numerical Analysis · Mathematics 2020-06-11 Yousef Saad , Mohamed El-Guide , Agnieszka Międlar

We propose a decision-theoretic framework for computational complexity, complementary to classical theory: moving from syntactic exactness (Turing / Shannon) to semantic simulability (Le Cam). While classical theory classifies problems by…

Statistics Theory · Mathematics 2026-01-01 Deniz Akdemir

We present Epsilon, a system for general convex programming using fast linear and proximal operators. As with existing convex programming frameworks, users specify convex optimization problems using a natural grammar for mathematical…

Optimization and Control · Mathematics 2015-11-17 Matt Wytock , Po-Wei Wang , J. Zico Kolter

Sequence classification algorithms, such as SVM, require a definition of distance (similarity) measure between two sequences. A commonly used notion of similarity is the number of matches between $k$-mers ($k$-length subsequences) in the…

Data Structures and Algorithms · Computer Science 2017-12-13 Muhammad Farhan , Juvaria Tariq , Arif Zaman , Mudassir Shabbir , Imdad Ullah Khan

Function regression/approximation is a fundamental application of machine learning. Neural networks (NNs) can be easily trained for function regression using a sufficient number of neurons and epochs. The forward-forward learning algorithm…

Machine Learning · Computer Science 2025-10-16 Shivam Padmani , Akshay Joshi

Previous work has shown the effectiveness of random walk hitting times as a measure of dissimilarity in a variety of graph-based learning problems such as collaborative filtering, query suggestion or finding paraphrases. However,…

Data Structures and Algorithms · Computer Science 2013-04-17 Joel Lang , James Henderson

The ODE method has been a workhorse for algorithm design and analysis since the introduction of the stochastic approximation. It is now understood that convergence theory amounts to establishing robustness of Euler approximations for ODEs,…

Optimization and Control · Mathematics 2020-10-02 Shuhang Chen , Adithya Devraj , Andrey Bernstein , Sean Meyn

We analyze the Gaussian approximation as a method to obtain the first and second moments of a stochastic process described by a master equation. We justify the use of this approximation with ideas coming from van Kampen's expansion approach…

Statistical Mechanics · Physics 2015-05-18 Luis F. Lafuerza , Raul Toral

As machine learning applications grow increasingly ubiquitous and complex, they face an increasing set of requirements beyond accuracy. The prevalent approach to handle this challenge is to aggregate a weighted combination of requirement…

Machine Learning · Computer Science 2026-01-07 Aneesh Barthakur , Luiz F. O. Chamon

Sparse approximation is important in many applications because of concise form of an approximant and good accuracy guarantees. The theory of compressed sensing, which proved to be very useful in the image processing and data sciences, is…

Numerical Analysis · Mathematics 2025-02-20 V. Temlyakov