calculate_teints_gaussian_basis_set Subroutine

public subroutine calculate_teints_gaussian_basis_set(env, atm, bas, first_bf_of_shell, n_basis, teint, accuracy)

computes all two-electron integrals

Arguments

Type IntentOptional Attributes Name
real(kind=long), intent(in) :: env(:)
integer, intent(in) :: atm(:,:)
integer, intent(in) :: bas(:,:)
integer, intent(in) :: first_bf_of_shell(:)
integer, intent(in) :: n_basis
real(kind=long), intent(out), allocatable :: teint(:)
real(kind=long), optional :: accuracy