siesta_run.f90 File Reference

Contains module siesta_run. More...

Data Types
interface	siesta_run::siesta_run_class
	Interface for the siesta_run constructor. More...

Modules
module	siesta_run
	Defines the base class of the type siesta_run_class. This module contains all the code necessary to interface setup and run SIESTA.

Functions/Subroutines
class(siesta_run_class) function, pointer	siesta_run::siesta_run_construct (run_comm, verbose, init_mpi, close_w
	Construct new siesta_run_class object. More...
subroutine	siesta_run::siesta_run_destruct (this)
	Deconstruct a siesta_run_class object. More...
real(dp) function	siesta_run::siesta_run_get_1d (this, param_name, index)
	Get 1D parameter value. More...
subroutine	siesta_run::siesta_run_converge (this)
	Solves the SIESTA equilibrium. More...
subroutine	siesta_run::siesta_run_sync (this)
	Sync child equilibria. More...

Variables
integer, parameter	siesta_run::siesta_run_control_clear = 0
	Clear all control bits.
integer, parameter	siesta_run::siesta_run_control_mpi = 1
	Bit position to initalize mpi.
integer, parameter	siesta_run::siesta_run_control_wout = 2
	Bit position to close the wout file.
integer, parameter	siesta_run::siesta_run_sync_namelist = 3
	Bit position to sycn the namelist inputs.

Detailed Description

Contains module siesta_run.