Frequently Used Modules

In this section, we introduce some of the most frequently used modules. See Package Reference for their APIs and other modules in KLIFF.

Quick links

Models	Dataset
Calculators	Loss

Note

See also Package Reference.

List of All Modules

• Dataset
  • Inspect dataset
  • Dataset Format
  • Weight
• Models
• Model Class Documentation
  • Constructor
  • Required Methods (To Be Implemented in Subclass)
  • Model Info Methods
  • Parameter Configuration
  • Saving and Loading
  • Parameter Utilities
• KIM models
• Neural network models
• Descriptors
  • Symmetry functions
  • Bispectrum
• Calculators
• Loss
  • Built-in residual function
  • Use your own residual function
• Uncertainty Quantification (UQ)
  • MCMC
  • Bootstrap