forked from lijiext/lammps
19 lines
844 B
Plaintext
19 lines
844 B
Plaintext
-- Engine code directory --
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* This is the directory containing all the major class definitions.
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* Files:
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- atoms.py: Deals with classical simulations.
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- barostats.py: Deals with constant pressure simulations.
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- beads.py: Deals with quantum simulations.
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- cell.py: Deals with the simulation box.
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- ensembles.py: Deals with the different ensembles.
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- forces.py: Deals with creating the jobs to send to the driver code.
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- initializer.py: Deals with initialization of the simulation.
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- normalmodes.py: Deals with the normal mode transformations.
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- outputs.py: Deals with the output files.
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- properties.py: Deals with calculating all the output properties.
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- simulation.py: Deals with all the top level information, such as
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input/output.
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- thermostats.py: Deals with constant temperature simulations.
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