poisson.F90 File Reference

Go to the source code of this file.

Modules
module	poisson_oct_m

Data Types
type	poisson_oct_m::poisson_t

Functions/Subroutines
subroutine, public	poisson_oct_m::poisson_init (this, namespace, space, der, mc, stencil, qtot, label, solver, verbose, force_serial, force_cmplx)
subroutine, public	poisson_oct_m::poisson_end (this)
subroutine	poisson_oct_m::zpoisson_solve_real_and_imag_separately (this, namespace, pot, rho, all_nodes, kernel)
subroutine, public	poisson_oct_m::zpoisson_solve (this, namespace, pot, rho, all_nodes, kernel)
subroutine, public	poisson_oct_m::poisson_solve_batch (this, namespace, potb, rhob, all_nodes, kernel)
subroutine, public	poisson_oct_m::dpoisson_solve (this, namespace, pot, rho, all_nodes, kernel)
	Calculates the Poisson equation. Given the density returns the corresponding potential. More...
subroutine, public	poisson_oct_m::poisson_init_sm (this, namespace, space, main, der, sm, method, force_cmplx)
subroutine, public	poisson_oct_m::poisson_test (this, space, mesh, latt, namespace, repetitions)
	This routine checks the Hartree solver selected in the input file by calculating numerically and analytically the Hartree potential originated by a Gaussian distribution of charge. For periodic systems, the periodic copies of the Gaussian are taken into account up to to a certain threshold that can be specified in the input file. More...
logical pure function, public	poisson_oct_m::poisson_solver_is_iterative (this)
logical pure function, public	poisson_oct_m::poisson_is_multigrid (this)
logical pure function, public	poisson_oct_m::poisson_solver_has_free_bc (this)
integer pure function, public	poisson_oct_m::poisson_get_solver (this)
subroutine, public	poisson_oct_m::poisson_async_init (this, mc)
subroutine, public	poisson_oct_m::poisson_async_end (this, mc)
subroutine, public	poisson_oct_m::poisson_slave_work (this, namespace)
logical pure function, public	poisson_oct_m::poisson_is_async (this)
subroutine, public	poisson_oct_m::poisson_build_kernel (this, namespace, space, coulb, qq, alpha, beta, mu, singul)
real(real64) function, public	poisson_oct_m::poisson_get_full_range_weight (this, alpha, beta, mu)
	Most Poisson solvers do not implement Coulomb attenuated potentials, and can only be used for global hybrids like PBE0. For these ones, this routine returns the weight of the full-range hybrids. More...
subroutine	poisson_oct_m::poisson_kernel_init (this, namespace, space, mc, stencil)
subroutine	poisson_oct_m::poisson_solve_direct (this, namespace, pot, rho)
subroutine	poisson_oct_m::dpoisson_solve_direct_sm (this, namespace, sm, pot, rho)
subroutine	poisson_oct_m::zpoisson_solve_direct_sm (this, namespace, sm, pot, rho)
subroutine, public	poisson_oct_m::dpoisson_solve_start (this, rho)
subroutine, public	poisson_oct_m::dpoisson_solve_finish (this, pot)
subroutine, public	poisson_oct_m::dpoisson_solve_sm (this, namespace, sm, pot, rho, all_nodes)
	Calculates the Poisson equation. Given the density returns the corresponding potential. More...
subroutine, public	poisson_oct_m::zpoisson_solve_start (this, rho)
subroutine, public	poisson_oct_m::zpoisson_solve_finish (this, pot)
subroutine, public	poisson_oct_m::zpoisson_solve_sm (this, namespace, sm, pot, rho, all_nodes)
	Calculates the Poisson equation. Given the density returns the corresponding potential. More...

Variables
integer, parameter, public	poisson_oct_m::poisson_direct_sum = -1
integer, parameter, public	poisson_oct_m::poisson_fft = 0
integer, parameter, public	poisson_oct_m::poisson_cg = 5
integer, parameter, public	poisson_oct_m::poisson_cg_corrected = 6
integer, parameter, public	poisson_oct_m::poisson_multigrid = 7
integer, parameter, public	poisson_oct_m::poisson_isf = 8
integer, parameter, public	poisson_oct_m::poisson_psolver = 10
integer, parameter, public	poisson_oct_m::poisson_no = -99
integer, parameter, public	poisson_oct_m::poisson_null = -999
integer, parameter	poisson_oct_m::cmd_finish = 1
integer, parameter	poisson_oct_m::cmd_poisson_solve = 2