Handling of the Wiener process currently employed in turn of the Langevin dynamics. More...

Functions/Subroutines
subroutine, public	create_wiener_process (md_env)
	Create a Wiener process for Langevin dynamics and initialize an independent random number generator for each atom in all force environment and all the subsystems/fragments therein.

subroutine, public	create_wiener_process_cv (meta_env)
	Create a Wiener process for Langevin dynamics used for metadynamics and initialize an independent random number generator for each COLVAR.

Detailed Description

Handling of the Wiener process currently employed in turn of the Langevin dynamics.

History: none

Author: Matthias Krack (05.07.2005)

Function/Subroutine Documentation

◆ create_wiener_process()

subroutine, public wiener_process::create_wiener_process ( type(md_environment_type), pointer md_env )

Create a Wiener process for Langevin dynamics and initialize an independent random number generator for each atom in all force environment and all the subsystems/fragments therein.

Parameters

md_env ...

History: Creation (06.07.2005,MK)

Definition at line 63 of file wiener_process.F.

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◆ create_wiener_process_cv()

subroutine, public wiener_process::create_wiener_process_cv ( type(meta_env_type), pointer meta_env )

Create a Wiener process for Langevin dynamics used for metadynamics and initialize an independent random number generator for each COLVAR.