chemparseplot chemparseplot chemparseplot
    • rgpycrumbs CLI suite, surfaces, and eOn plot dispatch
    • eOn Long-timescale MD / NEB engine
    • pychum ORCA / NWChem input generation
  • PyPI
/

Getting Started

  • Quickstart
  • Installation
  • Features

Guides

  • Tutorial Introduction
  • Tutorial: ORCA NEB Parsing and Plotting
  • Contributing tutorials

How-to

  • How-to Guides
  • Installation Guide
  • How-to: Parse ORCA NEB Calculations
  • How-to: Parse eOn NEB Calculations
  • How-to: Create Publication NEB Figures
  • Frequently Asked Questions
  • Troubleshooting Guide
  • How-to: Run Tests and Check Coverage

Explanation

  • Explanation
  • Architecture Overview
  • Lazy Import Pattern
  • NEB Parsing Design
  • ORCA NEB Integration Design
  • How to Cite chemparseplot

Reference guides

  • Reference
  • Glossary
  • ORCA NEB API Reference
  • eOn NEB API Reference
  • Plotting API Reference
  • Release Process

Reference

  • API Reference
    • chemparseplot
      • chemparseplot.plot
      • chemparseplot.parse
      • chemparseplot.units
      • chemparseplot.util
      • chemparseplot.api
  • Used By
  • Overview
  • One-shot multi-plot
  • Interactive plots

Development

  • Developer Documentation
  • Contributing Guidelines
  • Best Practices

On this page

  • Submodules
  • Package Contents
    • Data
    • API
      • __all__
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chemparseplot.parse.trajectory#

Submodules#

  • chemparseplot.parse.trajectory.neb
  • chemparseplot.parse.trajectory.hdf5

Package Contents#

Data#

__all__

API#

chemparseplot.parse.trajectory.__all__#

[‘hdf5’, ‘neb’]

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