Hierarchical visualization of materials space with graph convolutional neural networks

by Xie, Tian, Grossman, Jeffrey C.
Published 2020

Crystal Graph Convolutional Neural Networks for an Accurate and Interpretable Prediction of Material Properties

by Xie, Tian, Grossman, Jeffrey C.
Published 2018

Predicting charge density distribution of materials using a local-environment-based graph convolutional network

by Gong, Sheng, Xie, Tian, Zhu, Taishan, Wang, Shuo, Fadel, Eric R., Grossman, Jeffrey C.
Published 2021

Charting lattice thermal conductivity for inorganic crystals and discovering rare earth chalcogenides for thermoelectrics

by Zhu, Taishan, He, Ran, Gong, Sheng, Xie, Tian, Gorai, Prashun, Nielsch, Kornelius, Grossman, Jeffrey C.
Published 2021