Preview

NEP_dataset
- .DS_Store
  
  8.2 kB
- PBE+D3
  - nep.txt
    
    115.5 kB
  - train.xyz
    
    45.7 MB
- README
  
  746 Bytes
- SCAN
  - nep.txt
    
    39.6 kB
  - train.xyz
    
    159.3 MB
- optB88-vdw
  - nep.txt
    
    115.5 kB
  - train.xyz
    
    92.8 MB
- rSCAN
  - .DS_Store
    
    6.1 kB
  - nep_v1.txt
    
    39.6 kB
  - nep_v2.txt
    
    115.5 kB
  - run_PIMD.in
    
    303 Bytes
  - run_calssical.in
    
    314 Bytes
  - train.xyz
    
    101.2 MB
__MACOSX
- NEP_dataset
  - ._.DS_Store
    
    120 Bytes
  - ._README
    
    176 Bytes
  - PBE+D3
    - ._train.xyz
      
      220 Bytes
  - rSCAN
    - ._.DS_Store
      
      120 Bytes
    - ._train.xyz
      
      220 Bytes