cp_control_types::sccs_control_type Type Reference

Data Fields
logical	sccs_activated = .FALSE.
integer	derivative_method = 0
integer	max_iter = 0
integer	method_id = 0
real(kind=dp)	alpha_solvent = 0.0_dp
real(kind=dp)	beta = 0.0_dp
real(kind=dp)	beta_solvent = 0.0_dp
real(kind=dp)	delta_rho = 0.0_dp
real(kind=dp)	eps_sccs = 0.0_dp
real(kind=dp)	eps_scf = 0.0_dp
real(kind=dp)	epsilon_solvent = 0.0_dp
real(kind=dp)	gamma_solvent = 0.0_dp
real(kind=dp)	mixing = 0.0_dp
real(kind=dp)	rho_zero = 0.0_dp
real(kind=dp)	rho_max = 0.0_dp
real(kind=dp)	rho_min = 0.0_dp

Detailed Description

Definition at line 388 of file cp_control_types.F.

Field Documentation

sccs_activated

logical cp_control_types::sccs_control_type::sccs_activated = .FALSE.

Definition at line 389 of file cp_control_types.F.

derivative_method

integer cp_control_types::sccs_control_type::derivative_method = 0

Definition at line 390 of file cp_control_types.F.

max_iter

integer cp_control_types::sccs_control_type::max_iter = 0

Definition at line 390 of file cp_control_types.F.

method_id

integer cp_control_types::sccs_control_type::method_id = 0

Definition at line 390 of file cp_control_types.F.

alpha_solvent

real(kind=dp) cp_control_types::sccs_control_type::alpha_solvent = 0.0_dp

Definition at line 393 of file cp_control_types.F.

beta

real(kind=dp) cp_control_types::sccs_control_type::beta = 0.0_dp

Definition at line 393 of file cp_control_types.F.

beta_solvent

real(kind=dp) cp_control_types::sccs_control_type::beta_solvent = 0.0_dp

Definition at line 393 of file cp_control_types.F.

delta_rho

real(kind=dp) cp_control_types::sccs_control_type::delta_rho = 0.0_dp

Definition at line 393 of file cp_control_types.F.

eps_sccs

real(kind=dp) cp_control_types::sccs_control_type::eps_sccs = 0.0_dp

Definition at line 393 of file cp_control_types.F.

eps_scf

real(kind=dp) cp_control_types::sccs_control_type::eps_scf = 0.0_dp

Definition at line 393 of file cp_control_types.F.

epsilon_solvent

real(kind=dp) cp_control_types::sccs_control_type::epsilon_solvent = 0.0_dp

Definition at line 393 of file cp_control_types.F.

gamma_solvent

real(kind=dp) cp_control_types::sccs_control_type::gamma_solvent = 0.0_dp

Definition at line 393 of file cp_control_types.F.

mixing

real(kind=dp) cp_control_types::sccs_control_type::mixing = 0.0_dp

Definition at line 393 of file cp_control_types.F.

rho_zero

real(kind=dp) cp_control_types::sccs_control_type::rho_zero = 0.0_dp

Definition at line 393 of file cp_control_types.F.

rho_max

real(kind=dp) cp_control_types::sccs_control_type::rho_max = 0.0_dp

Definition at line 393 of file cp_control_types.F.

rho_min

real(kind=dp) cp_control_types::sccs_control_type::rho_min = 0.0_dp

Definition at line 393 of file cp_control_types.F.

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The documentation for this type was generated from the following file:

• cp_control_types.F