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Dan Thoma

Publications and source records attributed to Dan Thoma.

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Construction of Multi-Dimensional Functions for Optimization of Additive-Manufacturing Process Parameters

The authors present a generic framework for the parameter optimization of additive manufacturing (AM) processes, one tailored to a high-throughput experimental methodology (HTEM). Given the large number of parameters, which impact the quality of AM-metallic components, the authors advocate for partitioning the AM parameter set into stages (tiers), based on their relative importance, modeling one tier at a time until successful, and then systematically expanding the framework. The authors demonstrate how the construction of multi-dimensional functions, based on neural networks (NN), can be applied to successfully model relative densities and Rockwell hardness obtained from HTEM testing of the Inconel 718 superalloy fabricated, using a powder-bed approach. The authors analyze the input data set, assess its suitability for predictions, and show how to optimize the framework for the multi-dimensional functional construction, such as to obtain the highest degree of fit with the input data set. The authors also compare and contrast the NN-based multi-dimensional functional construction to multi-variate linear regression, to polynomial regression, and to Gaussian process regression (GPR), highlight similarity between the NN-based multi-dimensional functional construction and the GPR, and offer insights into the suitability of each of these methods for the data set and the application at hand. In terms of the coefficient of determination, $R^2$, a relatively simple, single-layer NN with 5 or 10 nodes outperforms multi-variate linear regression, 2nd-order polynomial regression, and GPR for the primary Inconel 718 HTEM data set studied. The novelty of the research work entails the versatile and scalable NN framework presented, suitable for use in conjunction with HTEM, for the AM parameter optimization of superalloys, and beyond.

cond-mat.mtrl-sci

Machine Learning Prediction of Critical Cooling Rate for Metallic Glasses From Expanded Datasets and Elemental Features

We use a random forest model to predict the critical cooling rate (RC) for glass formation of various alloys from features of their constituent elements. The random forest model was trained on a database that integrates multiple sources of direct and indirect RC data for metallic glasses to expand the directly measured RC database of less than 100 values to a training set of over 2,000 values. The model error on 5-fold cross validation is 0.66 orders of magnitude in K/s. The error on leave out one group cross validation on alloy system groups is 0.59 log units in K/s when the target alloy constituents appear more than 500 times in training data. Using this model, we make predictions for the set of compositions with melt-spun glasses in the database, and for the full set of quaternary alloys that have constituents which appear more than 500 times in training data. These predictions identify a number of potential new bulk metallic glass (BMG) systems for future study, but the model is most useful for identification of alloy systems likely to contain good glass formers, rather than detailed discovery of bulk glass composition regions within known glassy systems.

cond-mat.mtrl-sci