Wrapper class for solving symmetric general eigenvalue problems. More...

Inheritance diagram for tblite_lapack_sygvd::sygvd_solver:

Public Member Functions
procedure	solve_sp (self, hmat, smat, eval, error)

procedure	solve_dp (self, hmat, smat, eval, error)

Public Member Functions inherited from tblite_scf_diag::diag_solver_type
generic	solve (self, hmat, smat, eval, error)

generic	solve (self, hmat, smat, eval, error)

procedure(solve_sp), deferred	solve_sp (self, hmat, smat, eval, error)

procedure(solve_dp), deferred	solve_dp (self, hmat, smat, eval, error)

procedure	get_density (self, hmat, smat, eval, focc, density, error)

procedure	get_wdensity (self, hmat, smat, eval, focc, density, error)

procedure	delete (self)
	Delete the solver instance.

Public Member Functions inherited from tblite_scf_solver::solver_type
procedure(get_density), deferred	get_density (self, hmat, smat, eval, focc, density, error)

procedure(get_density), deferred	get_wdensity (self, hmat, smat, eval, focc, density, error)

procedure(delete), deferred	delete (self)

Data Fields
integer, dimension(:), allocatable	iwork

real(sp), dimension(:), allocatable	swork

real(sp), dimension(:, :), allocatable	sbmat

real(dp), dimension(:), allocatable	dwork

real(dp), dimension(:, :), allocatable	dbmat

Data Fields inherited from tblite_scf_solver::solver_type
real(wp)	kt
	Electronic temperature.

real(wp), dimension(:), allocatable	nel
	Number of electrons per spin channel.

Detailed Description

Wrapper class for solving symmetric general eigenvalue problems.

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

Public Member Functions