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qp2/plugins/local/ao_extra_basis/extra_basis.irp.f
2024-12-06 14:55:44 +01:00

17 lines
412 B
Fortran

program extra_basis
implicit none
BEGIN_DOC
! TODO : Put the documentation of the program here
END_DOC
integer :: i
print*,'extra_nucl_num = ',extra_nucl_num
do i = 1, extra_nucl_num
print*,'i = ',i
print*,'extra_nucl_label = ',extra_nucl_label(i)
print*,'extra_nucl_charge = ',extra_nucl_charge(i)
print*,'extra_nucl_coord = '
print*,extra_nucl_coord(i,1:3)
enddo
print*,ao_extra_num
end