LatticeML: A data-driven application for predicting the effective Young Modulus of high temperature graph based architected materials

Abstract

Architected materials with their unique topology and geometry offer the potential to modify physical and mechanical properties. Machine learning can accelerate the design and optimization of these materials by identifying optimal designs and forecasting performance. This work presents LatticeML, a data-driven application for predicting the effective Young's Modulus of high-temperature graph-based architected materials. The study considers eleven graph-based lattice structures with two high-temperature alloys, Ti-6Al-4V and Inconel 625. Finite element simulations were used to compute the effective Young's Modulus of the 2x2x2 unit cell configurations. A machine learning framework was developed to predict Young's Modulus, involving data collection, preprocessing, implementation of regression models, and deployment of the best-performing model. Five supervised learning algorithms were evaluated, with the XGBoost Regressor achieving the highest accuracy (MSE = 2.7993, MAE = 1.1521, R-squared = 0.9875). The application uses the Streamlit framework to create an interactive web interface, allowing users to input material and geometric parameters and obtain predicted Young's Modulus values.