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Efficient approach to optimization under uncertainty with application to large scale engineering systems.

机译:在不确定性条件下进行优化的有效方法,应用于大型工程系统。

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Increasing model complexities of various engineering systems, coupled with a growing number of design choices creates a challenging problem of finding the optimal design of the engineering system with minimum computational efforts. Additionally, real-life large-scale engineering systems are prone to several sources of uncertainties, like model prediction imprecision. These further hinder the process of obtaining a reliable and robust design. Furthermore, huge CPU requirements of the system model restrict conventional optimization methods to comparatively smaller scale engineering problems, invariably ignoring uncertainties. This research focuses on the development of an efficient optimization framework under uncertainty, for engineering system models of varied complexities.; The main contributions of this work include: (a) First successful application of genetic algorithms for optimal design of heat exchangers, using black box models; (b) A parallel optimization framework using Supercomputers for computationally efficient optimal heat exchanger design; (c) A novel sampling approach to stochastic optimization for Computer Aided Molecular Design (CAMD) under property prediction uncertainty, enabling sensitivity analysis of the model parameters and obtaining optimal molecular designs for desired properties; (d) Improved computational efficiency of the Monte Carlo algorithm for molecular simulations by using a new highly-efficient sampling technique replacing costly Monte Carlo samples; (e) Improved overall efficiency and accuracy of the generalized engineering systems and optimization framework for optimization under uncertainty at the levels of the model, sampler, and the optimizer.; The modeling environments considered include the black-box model for heat exchanger design from the Heat Transfer Research Institute (HTRI), simpler and transparent group contribution models (GCM) for property prediction of polymers, complex molecular simulation models based on statistical mechanics for property prediction of molecules and the Computer Aided Engineering (CAE) models used in manufacturing industries, that also act as a black box.
机译:各种工程系统的模型复杂性不断提高,再加上越来越多的设计选择,带来了一个挑战性的问题,即以最少的计算量来找到工程系统的最佳设计。此外,现实生活中的大规模工程系统容易受到多种不确定因素的影响,例如模型预测的不精确性。这些进一步阻碍了获得可靠且坚固的设计的过程。此外,系统模型对CPU的巨大需求将传统的优化方法限制在相对较小规模的工程问题上,而始终无视不确定性。这项研究的重点是在不确定性下为各种复杂的工程系统模型开发有效的优化框架。这项工作的主要贡献包括:(a)使用黑盒模型首次成功地将遗传算法成功应用于热交换器的最佳设计; (b)使用超级计算机的并行优化框架,用于计算效率高的最佳热交换器设计; (c)在属性预测不确定性下对计算机辅助分子设计(CAMD)进行随机优化的一种新颖的采样方法,可以对模型参数进行敏感性分析,并获得所需特性的最佳分子设计; (d)通过使用新的高效采样技术代替昂贵的蒙特卡洛样本,提高了分子模拟的蒙特卡洛算法的计算效率; (e)提高了通用工程系统和优化框架的整体效率和准确性,从而可以在模型,采样器和优化器级别的不确定性下进行优化;所考虑的建模环境包括来自热传递研究所(HTRI)的用于热交换器设计的黑匣子模型,用于聚合物性质预测的简单透明的基团贡献模型(GCM),基于统计力学的复杂分子模拟模型用于性质预测分子和制造业中使用的计算机辅助工程(CAE)模型,它们也充当黑匣子。

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