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qp2/src/tools/write_integrals_erf.irp.f
2019-01-25 11:39:31 +01:00

21 lines
421 B
Fortran

program write_integrals_erf
implicit none
BEGIN_DOC
! Saves the two-electron integrals with the :math:`erf(\mu r_{12})/r_{12}` oprerator into the EZFIO folder
END_DOC
io_mo_two_e_integrals = 'None'
touch io_mo_two_e_integrals
io_ao_two_e_integrals = 'None'
touch io_ao_two_e_integrals
call routine
end
subroutine routine
implicit none
call save_erf_two_e_integrals_ao
call save_erf_two_e_integrals_mo
end