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1.
Nat Commun ; 12(1): 18, 2021 01 04.
Article in English | MEDLINE | ID: mdl-33398000

ABSTRACT

Energy affects every single individual and entity in the world. Therefore, it is crucial to precisely quantify the "price of energy" and study how it evolves through time, through major political and social events, and through changes in energy and monetary policies. Here, we develop a predictive framework, an index to calculate the average price of energy in the United States. The complex energy landscape is thoroughly analysed to accurately determine the two key factors of this framework: the total demand of the energy products directed to the end-use sectors, and the corresponding price of each product. A rolling horizon predictive methodology is introduced to estimate future energy demands, with excellent predictive capability, shown over a period of 174 months. The effectiveness of the framework is demonstrated by addressing two policy questions of significant public interest.

2.
AIChE J ; 66(10)2020 Oct.
Article in English | MEDLINE | ID: mdl-32921798

ABSTRACT

Support Vector Machines (SVMs) based optimization framework is presented for the data-driven optimization of numerically infeasible Differential Algebraic Equations (DAEs) without the full discretization of the underlying first-principles model. By formulating the stability constraint of the numerical integration of a DAE system as a supervised classification problem, we are able to demonstrate that SVMs can accurately map the boundary of numerical infeasibility. The necessity of this data-driven approach is demonstrated on a 2-dimensional motivating example, where highly accurate SVM models are trained, validated, and tested using the data collected from the numerical integration of DAEs. Furthermore, this methodology is extended and tested for a multi-dimensional case study from reaction engineering (i.e., thermal cracking of natural gas liquids). The data-driven optimization of this complex case study is explored through integrating the SVM models with a constrained global grey-box optimization algorithm, namely the ARGONAUT framework.

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