This file is automatically generated. It contains the descriptions of each uploaded file as provided by the user.
- NN_potential.zip: DeepMD potential for Ge₂Sb₂Te₅
- DB.zip: The DFT database used to fit the NN potential divided into cubic, hexagonal, and disordered configurations (i.e. liquid, supercooled liquid, and amorphous phases). The disordered configurations are furtherly divided into configurations from DFT MD simulations, from NN MD simulations, and NN metadynamics simulations. The database is provided in DeepMD format.
- Crystallization_trajectories.zip: Trajectories files of the homogeneous crystallization at 600 K and heterogeneous crystallization at 610 K
- crystallization_610K.mp4: Video of heterogeneous crystallization dynamics at 610 K