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Table of Contents

  • Installation
    • Requirements
    • Usage
  • Models
    • Building a model
    • Fitting the model
    • Predicting forces and energies with the GP
    • Building a mapped potential
    • Saving and loading a model
    • Model’s complete reference
    • Two Body Model
    • Three Body Model
    • Combined Model
    • Eam Model
  • Configurations
  • Gaussian Processes
    • Two Body Kernel
    • Three Body Kernel
  • Calculators
    • Theory/Introduction
    • Example
  • API Reference
    • The “models” module
    • The “gp” module
    • The “configurations” module
    • The “calculators” module
    • The “kernels” module
    • The “utility” module

Appendix

  • Index
MFF
  • Docs »
  • Python Module Index

Python Module Index

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    mff.configurations
    mff.gp
    mff.kernels.threebodykernel
    mff.kernels.twobodykernel
    mff.models.combined
    mff.models.eam
    mff.models.threebody
    mff.models.twobody