Doctor of Philosophy, The Ohio State University, 2020, Materials Science and Engineering
In the past several decades, there has been an unprecedented demand for the discovery and design of new materials to support rapidly advancing technology. This demand has fueled a push for Integrated Computational Materials Engineering (ICME), an engineering approach whereby model linkages as well as experimental and computational integration are exploited in order to efficiently explore materials processing-to-performance relationships. Tailored simulations allow for the reduction of expensive and lengthy experiments, emphasizing the need to establish a statistical confidence in component designs and manufacturing processes from the simulations, rather than experiments, in a principled way. Since many materials models and simulations are deterministic in nature, the use of sophisticated tools and techniques are required.
Achieving a statistical confidence in a simulation output requires, first, the identification of the various sources of error and uncertainty affecting the simulation results. These sources include machine and user error in collecting calibration data, uncertain model parameters, random error from natural processes, and model inadequacy in capturing the true material property or behavior. Statistical inference can then be used to recover information about unknown model parameters by conditioning on available data while taking into account the various sources of uncertainty.
In this work, Bayesian inference is used to quantify and propagate uncertainty in simulations of material behavior. More specifically, a random effects hierarchical framework is used since it provides a way to account for uncertainty stemming from random natural processes or conditions. This is especially important in many materials modeling applications where the random microstructure plays an important role in dictating material behavior. In addition to this, in many cases experiments are quite costly, so in order to obtain sufficient data for calibration, a compilation (open full item for complete abstract)
Committee: Stephen Niezgoda (Advisor); Oksana Chkrebtii (Committee Member); Yunzhi Wang (Committee Member); Alan Luo (Committee Member)
Subjects: Materials Science; Statistics