Schwi

During the process of generating a new iteration using dpgen run, an error occurred and the file in the directory could not be found, but it does exist in that path

2

### Bug summary FileNotFoundError: [Errno 2] No such file or directory: '/data/Li6PS5Cl/Jan_30_2023/LPSC_bulk_run/Li_bulk_LPSC_bulk_27_02_2023/hh/Start_from_iter64_R/iter.000066/01.model_devi/fcc17e79fc3e82135a37195a591e26535d142d01_back.zip'  ### DeePMD-kit Version 2.1.5 ### TensorFlow Version 2.5.0 ### How did you download the software? Offline packages...

Using the DP model to predict the energy of each frame structure in the LAMMPS trajectory

1

### Summary I now have a lambps trajectory that contains many structures, but these structures are not the original lambps trajectory structure, but some extracted molecular clusters. Therefore, the number...