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Uses the [Atomic Simulation Environment](https://wiki.fysik.dtu.dk/ase/) (ASE) library.
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Simulations are run using the `sim_controller.py` script, and simulation parameters are stored in [config files](config file). Example config files are stored in the config directory. The energy of the system is calculated from simple [potentials](Potentials) between the different elements. After the simulation a [report file](report file) is created.
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Simulations are run using the `sim_controller.py` script. The script is controlled using [config files](config file) and commandline parameters. Example config files are stored in the config directory. The energy of the system is calculated from simple [potentials](Potentials) between the different elements. After the simulation a [report file](report file) is created.
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## Modules
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* [sim_controller.py](modules/sim_controller.py)
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