DESIGNING A FORMULATION OF A MATERIAL WITH COMPLEX DATA PROCESSING

摘要

A data processing system for processing data records in designing a formulation of a material. A plurality of data records are retrieved and processed by the data processing system to identify a training set of complex system responses for optimizing. The data processing system identifies system variables for varying the system response, identifies underlying physical interactions that determine system responses, performs simulations on simple model systems that probe physical variables, develops parametrized expressions that relate system variables to underlying physical variables, decomposes complex system responses according to the results from simple model systems, re-parametrizes the regression expression for system responses as a function of the underlying physical variables, optimizes the system by searching for global maxima or minima in the resulting function for system responses in terms of system variables, and tests model predictions and integrate results to improve and refine the algorithm via methods of machine learning.