Overview

1. Introduction
2. Installation
3. Simulations
4. Parameter Refinement
5. Contributing to MDMC

Tutorials

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Reading atoms from configuration files
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Creating an Observable from a Simulation
Selecting Fitting Parameters
Running a Refinement
Argon A-to-Z

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Recipes for ‘simple’ additions
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Modules

common
control
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readers
refinement
trajectory_analysis
- trajectory
- observables
  - obs_factory
  - obs
  - PDF
  - SQw_coh
  - SQw_incoh
  - SQw

MDMC

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SQw_coh
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SQw_coh

A class for the coherent dynamic structure factor

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