no code implementations • 8 Sep 2021 • Yunqi Shao, Florian M. Dietrich, Carl Nettelblad, Chao Zhang
Here we compare the performance of two popular training algorithms, the adaptive moment estimation algorithm (Adam) and the Extended Kalman Filter algorithm (EKF), using the Behler-Parrinello neural network (BPNN) and two publicly accessible datasets of liquid water [Proc.