m_ia_tether Module

Tether potentials

Style none: None
Style harm: Harmonic tether
Style fene: Fene spring tether

Uses

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Used by

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Graph Key

Nodes of different colours represent the following:

Solid arrows point from a submodule to the (sub)module which it is descended from. Dashed arrows point from a module or program unit to modules which it uses.
Where possible, edges connecting nodes are given different colours to make them easier to distinguish in large graphs.

Subroutines

public subroutine ia_tether_setup(teth)

Sets up parameters for tether potentials

Arguments

Type	Intent	Optional	Attributes		Name
type(tether_t),	intent(inout)			::	teth

public subroutine ia_get_tether_energy(ri, teth, enrg, ierr)

Calculates the energy due to a tether.

Arguments

Type	Intent	Optional	Attributes		Name
real(kind=rp),	intent(in),		dimension(3)	::	ri	Coordinate of atom i
type(tether_t),	intent(in)			::	teth
real(kind=rp),	intent(out)			::	enrg
integer,	intent(out)			::	ierr

public subroutine teth_harm(r, teth, enrg)

Calculates energy for harmonic tether interaction.

Arguments

Type	Intent	Optional	Attributes		Name
real(kind=rp),	intent(in)			::	r
type(tether_t),	intent(in)			::	teth
real(kind=rp),	intent(out)			::	enrg

public subroutine teth_fene(r, teth, enrg, ierr)

Calculates energy for fene tether interaction.

Arguments

Type	Intent	Optional	Attributes		Name
real(kind=rp),	intent(in)			::	r
type(tether_t),	intent(in)			::	teth
real(kind=rp),	intent(out)			::	enrg
integer,	intent(out)			::	ierr