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Documentation of HAL’s MD package
¶
Introduction
Physics applications
Features
Historical footnote
Installation
Downloading the source code
Software prerequisites
Building
HAL’s MD package
Installation in Ubuntu
Usage
Getting started
H5MD data files
Plotting the results
Multi-GPU machines
Modules
Simulation
Numeric
Input and Output
Observables
Random Numbers
Utilities
Simulation units
Validation
Simple fluids
Binary mixtures
Benchmarks
Simple Lennard-Jones fluid in 3 dimensions
Supercooled binary mixture (Kob-Andersen)
FAQ
Developer guide
Development of
HAL’s MD package
Debugging
Floating-point precision
Short guide on Luabind
How to write a HALMD module
Redmine
Coding conventions
Test suite
Changelog
Version 0.2.1
Version 0.2.0
Version 0.1.2
Version 0.1.2
Version 0.1.1
Version 0.1.0
Documentation archive
Table Of Contents
Introduction
Installation
Usage
Modules
Simulation units
Validation
Benchmarks
FAQ
Developer guide
Changelog
Documentation archive
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