Documentation for module reftraj_util

Initialize the analysis of trajectories to be done by activating the REFTRAJ ensemble

source: reftraj_util.F
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public Subroutines/Functions:

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SUBROUTINEcompute_msd_reftraj(reftraj, md_env, particle_set)

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Arguments:
POINTER
:: reftraj ...
POINTER
:: md_env ...
POINTER
:: particle_set(:) ...

SUBROUTINEinitialize_reftraj(reftraj, reftraj_section, md_env)

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Arguments:
POINTER
:: reftraj ...
POINTER
:: reftraj_section ...
POINTER
:: md_env ...

SUBROUTINEwrite_output_reftraj(md_env)

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Arguments:
POINTER
:: md_env ...