Note that the model for inference is required to be compatible with the DeePMD-kit package. See Model compatibility for details.
dpdata ase lammps-command ipi gromacs out-of-deepmd-kit
Note that the model for inference is required to be compatible with the DeePMD-kit package. See Model compatibility for details.
dpdata ase lammps-command ipi gromacs out-of-deepmd-kit