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DP-GEN
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Overview

  • Overview
  • Command line interface
  • Code Structure

Workflow

  • Run
  • Init
  • Simplify
  • Auto test

Tutorial

  • Tutorials
  • Publications

User Guide

  • User Guide

Contributing Guide

  • Contributing Guide

Contribution

  • DP-GEN API
  • Authors
DP-GEN
  • DPGEN’s documentation
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DPGEN’s documentation

Overview

  • Overview
    • About DP-GEN
    • Download and install
    • Use DP-GEN
    • Case Studies
    • License
  • Command line interface
    • Sub-commands
  • Code Structure

Workflow

  • Run
    • Overview of the Run process
    • Example-of-param.json
    • Example of machine.json
    • dpgen run param parameters
    • dpgen run machine parameters
  • Init
    • Init_bulk
    • dpgen init_bulk parameters
    • dpgen init_bulk machine parameters
    • Init_surf
    • dpgen init_surf parameters
    • dpgen init_surf machine parameters
    • init_reaction
    • dpgen init_reaction parameters
    • dpgen init_reaction machine parameters
  • Simplify
    • Simplify
    • dpgen simplify parameters
    • dpgen simplify machine parameters
  • Auto test
    • Autotest Overview: Autotest for Deep Generator
    • Make run and post
    • Relaxation
    • Property
    • Refine
    • Reproduce

Tutorial

  • Tutorials
  • Publications

User Guide

  • User Guide
    • Discussions:
    • Issue:
    • Tutorials
    • Example for parameters
    • Pull requests - How to contribute
    • Troubleshooting
    • Common Errors

Contributing Guide

  • Contributing Guide
    • Contributing Guide

How to get help from the community

Contribution

  • DP-GEN API
    • dpgen package
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