Accelerating Reactive Transport Modeling: On-Demand Machine Learning Algorithm for Chemical Equilibrium Calculations

作者: Allan M. M. Leal , Svetlana Kyas , Dmitrii A. Kulik , Martin O. Saar

DOI: 10.1007/S11242-020-01412-1

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摘要: … cost of chemical equilibrium calculations (each requiring an iterative solution of a system of nonlinear … prediction of new chemical equilibrium states using the results of previously solved …

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