Introduction to Machine Learning in MSE: Predicting Bulk Modulus

By Abigail N Gentry1; Peilin Liao1

1. School of Materials Engineering, Purdue University

In this module, you will learn how to predict bulk modulus using machine learning.

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Version 1.0 - published on 29 Jan 2020

doi:10.21981/4PNZ-RA03 cite this

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Abstract

In this tool, you will learn how to...
- Predict bulk modulus using machine learning 
- Use data based algorithms to sort large and complex data 
- Apply clustering, classification and regression to data in a Materials Engineering context
- Make predictions and identify trends

Matminer is a materials focused machine learning program. The program can help with...
- Retrieving data from many different data bases
- Featurizing the data so that the data are usable for machine learning 
- Creating interactive visualizations 
 

 

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  • This notebook is adapted from "Matminer introduction - Predicting bulk modulus"

    https://github.com/hackingmaterials/matminer_examples/blob/master/matminer_examples/machine_learning-nb/bulk_modulus.ipynb

    Ward, L., Dunn, A., Faghaninia, A., Zimmermann, N. E. R., Bajaj, S., Wang, Q.,
    Montoya, J. H., Chen, J., Bystrom, K., Dylla, M., Chard, K., Asta, M., Persson,
    K., Snyder, G. J., Foster, I., Jain, A., Matminer: An open source toolkit for
    materials data mining. Comput. Mater. Sci. 152, 60-69 (2018).

  • Abigail N Gentry, Peilin Liao (2020), "Introduction to Machine Learning in MSE: Predicting Bulk Modulus," https://nanohub.org/resources/msemlg. (DOI: 10.21981/4PNZ-RA03).

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