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The optimal value function is one of the basic objects in the field of mathematical optimization, as it allows the evaluation of the variations in the cost/revenue generated while minimizing/maximizing a given function under some…

Optimization and Control · Mathematics 2021-11-29 Alain B. Zemkoho

We derive and implement a second-order adjoint method to compute exact gradients and Hessians for a prototypical quantum optimal control problem, that of solving for the minimal energy applied electric field that drives a molecule from a…

Quantum Physics · Physics 2025-05-02 Harish S. Bhat

Several quantities important in condensed matter physics, quantum information, and quantum chemistry, as well as quantities required in meta-optimization of machine learning algorithms, can be expressed as gradients of implicitly defined…

Quantum Physics · Physics 2022-11-28 Shahnawaz Ahmed , Nathan Killoran , Juan Felipe Carrasquilla Álvarez

Training deep neural networks consumes increasing computational resource shares in many compute centers. Often, a brute force approach to obtain hyperparameter values is employed. Our goal is (1) to enhance this by enabling second-order…

Machine Learning · Computer Science 2022-08-04 Severin Reiz , Tobias Neckel , Hans-Joachim Bungartz

First order methods, which solely rely on gradient information, are commonly used in diverse machine learning (ML) and data analysis (DA) applications. This is attributed to the simplicity of their implementations, as well as low…

Machine Learning · Computer Science 2018-03-06 Sudhir B. Kylasa , Farbod Roosta-Khorasani , Michael W. Mahoney , Ananth Grama

In a Hilbert space setting, for convex optimization, we analyze the convergence rate of a class of first-order algorithms involving inertial features. They can be interpreted as discrete time versions of inertial dynamics involving both…

Optimization and Control · Mathematics 2020-11-09 Hedy Attouch , Zaki Chbani , Jalal Fadili , Hassan Riahi

In this work, we propose Natural Hypergradient Descent (NHGD), a new method for solving bilevel optimization problems. To address the computational bottleneck in hypergradient estimation--namely, the need to compute or approximate Hessian…

Machine Learning · Computer Science 2026-04-02 Deyi Kong , Zaiwei Chen , Shuzhong Zhang , Shancong Mou

Even for the gradient descent (GD) method applied to neural network training, understanding its optimization dynamics, including convergence rate, iterate trajectories, function value oscillations, and especially its implicit acceleration,…

Machine Learning · Computer Science 2026-05-22 Alexander Tyurin

Differentiable programming is a fresh programming paradigm which composes parameterized algorithmic components and trains them using automatic differentiation (AD). The concept emerges from deep learning but is not only limited to training…

Strongly Correlated Electrons · Physics 2019-09-11 Hai-Jun Liao , Jin-Guo Liu , Lei Wang , Tao Xiang

Efficiently approximating local curvature information of the loss function is a key tool for optimization and compression of deep neural networks. Yet, most existing methods to approximate second-order information have high computational or…

Machine Learning · Computer Science 2021-11-19 Elias Frantar , Eldar Kurtic , Dan Alistarh

This report investigates the fitting of the Hessian or its inverse for stochastic optimizations using a Hessian fitting criterion derived from the preconditioned stochastic gradient descent (PSGD) method. This criterion is closely related…

Machine Learning · Statistics 2025-12-02 Xi-Lin Li

Solving semiparametric models can be computationally challenging because the dimension of parameter space may grow large with increasing sample size. Classical Newton's method becomes quite slow and unstable with intensive calculation of…

Computation · Statistics 2021-08-19 Yucong Lin , Jinhua Su , Yang Liu , Jue Hou , Feifei Wang

We derive methods to compute higher order differentials (Hessians and Hessian-vector products) of the rendering operator. Our approach is based on importance sampling of a convolution that represents the differentials of rendering…

Graphics · Computer Science 2025-08-07 Zican Wang , Michael Fischer , Tobias Ritschel

This paper presents an efficient method for extracting the second-order sensitivities from a system of implicit nonlinear equations on upcoming graphical processing units (GPU) dominated computer systems. We design a custom automatic…

In recent years, we have witnessed the emergence of scientific machine learning as a data-driven tool for the analysis, by means of deep-learning techniques, of data produced by computational science and engineering applications. At the…

Machine Learning · Computer Science 2024-03-20 Stefano Zampini , Umberto Zerbinati , George Turkiyyah , David Keyes

Accelerating the convergence of second-order optimization, particularly Newton-type methods, remains a pivotal challenge in algorithmic research. In this paper, we extend previous work on the \textbf{Quadratic Gradient (QG)} and rigorously…

Optimization and Control · Mathematics 2026-04-01 John Chiang

This is the second and final article on the tutorial on manipulator differential kinematics. In Part 1, we described a method of modelling kinematics using the elementary transform sequence (ETS), before formulating forward kinematics and…

Robotics · Computer Science 2023-05-17 Jesse Haviland , Peter Corke

Second order information is useful in many ways in smooth optimization problems, including for the design of step size rules and descent directions, or the analysis of the local properties of the objective functional. However, the…

Optimization and Control · Mathematics 2025-02-06 Marcus Carlsson , Viktor Nikitin , Erik Troedsson , Herwig Wendt

In this work, the Einstein notation is utilized to synthesize state and parameter transition matrices, by solving a set of ordinary differential equations. Additionally, for the system identification problem, it has been demonstrated that…

Systems and Control · Electrical Eng. & Systems 2024-07-08 Premjit Saha , Tarunraj Singh

Optimization in Deep Learning is mainly dominated by first-order methods which are built around the central concept of backpropagation. Second-order optimization methods, which take into account the second-order derivatives are far less…

Machine Learning · Computer Science 2021-04-09 Fares B. Mehouachi , Chaouki Kasmi