HAL’s MD package
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Simulation¶

  • Binning
  • Box
  • Clock
  • Core
  • Maximum Displacement
  • Neighbour List
  • Particle
  • Forces
    • Full Pair Force
    • Truncated Pair Force
    • Smoothing Functions
  • Integrators
    • Euler
    • Velocity Verlet
    • Velocity Verlet with Andersen thermostat
    • Velocity Verlet with Boltzmann distribution
    • Velocity Verlet with Nosé-Hoover thermostat
  • Particle Groups
    • All
    • From Range
  • Potentials
    • Lennard-Jones potential
    • Linearly truncated Lennard-Jones potential
    • Modified Lennard-Jones potential
    • Morse potential
    • Power-law potential
    • Power-law with hard core potential
  • Velocities
    • Boltzmann distribution
  • Positions
    • Excluded volume
    • Lattice
  • Sort algorithms
    • Hilbert sort

Table Of Contents

  • Introduction
  • Installation
  • Usage
  • Modules
    • Simulation
    • Numeric
    • Input and Output
    • Observables
    • Random Numbers
    • Utilities
  • Simulation units
  • Validation
  • Benchmarks
  • FAQ
  • Developer guide
  • Changelog
  • Documentation archive

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© Copyright 2007–2014 Felix Höfling, Peter Colberg, Nicolas Höft, Michael Kopp. Created using Sphinx 1.2.1.