Graph neural network for Hamiltonian-based material property prediction

Hexin Bai, Peng Chu, Jeng-Yuan Tsai, Nathan Wilson, Xiaofeng Qian, Qimin Yan, Haibin Ling. Graph neural network for Hamiltonian-based material property prediction. Neural Computing and Applications, 34(6):4625-4632, 2022. [doi]

Abstract

Abstract is missing.