The continuous stochastic gradient method: part II–application and numerics

IF 16.4 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY
Max Grieshammer, Lukas Pflug, Michael Stingl, Andrian Uihlein
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引用次数: 2

Abstract

In this contribution, we present a numerical analysis of the continuous stochastic gradient (CSG) method, including applications from topology optimization and convergence rates. In contrast to standard stochastic gradient optimization schemes, CSG does not discard old gradient samples from previous iterations. Instead, design dependent integration weights are calculated to form a convex combination as an approximation to the true gradient at the current design. As the approximation error vanishes in the course of the iterations, CSG represents a hybrid approach, starting off like a purely stochastic method and behaving like a full gradient scheme in the limit. In this work, the efficiency of CSG is demonstrated for practically relevant applications from topology optimization. These settings are characterized by both, a large number of optimization variables and an objective function, whose evaluation requires the numerical computation of multiple integrals concatenated in a nonlinear fashion. Such problems could not be solved by any existing optimization method before. Lastly, with regards to convergence rates, first estimates are provided and confirmed with the help of numerical experiments.

Abstract Image

连续随机梯度法:第二部分-应用与数值
在这篇贡献中,我们提出了连续随机梯度(CSG)方法的数值分析,包括拓扑优化和收敛速度的应用。与标准的随机梯度优化方案相比,CSG不会丢弃以前迭代的旧梯度样本。相反,计算与设计相关的积分权重以形成一个凸组合,作为当前设计中真实梯度的近似值。由于近似误差在迭代过程中逐渐消失,所以CSG是一种混合方法,一开始像纯随机方法,在极限情况下表现为全梯度方案。在本工作中,从拓扑优化的角度证明了CSG在实际应用中的有效性。这些设置的特点是,大量的优化变量和目标函数,其评估需要以非线性方式串联多个积分的数值计算。这些问题是现有的任何优化方法都无法解决的。最后,给出了收敛速度的初步估计,并通过数值实验进行了验证。
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来源期刊
Accounts of Chemical Research
Accounts of Chemical Research 化学-化学综合
CiteScore
31.40
自引率
1.10%
发文量
312
审稿时长
2 months
期刊介绍: Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance. Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.
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