The Neural Network Potential in Parallel

[LiMahappy]

Hi mjwen@mjwen , I am currently attempting to develop a neural network potential for a PtRh alloy. I have trained using a 2000-step AIMD dataset with KLIFF, but the resulting neural network potential has very low accuracy and is essentially unusable. Below is my input file. Additionally, I noticed on the official website that only physically-based potential training can be run in parallel mode. How can I run the neural network potential in parallel? nn_ptrh.txt Awaiting your reply.