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quantum_package/plugins/Integrals_restart_DFT/write_integrals_restart_dft.irp.f

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353 B
Fortran
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program write_integrals
implicit none
read_wf = .true.
touch read_wf
disk_access_only_mo_one_integrals = "None"
touch disk_access_only_mo_one_integrals
disk_access_mo_integrals = "None"
touch disk_access_mo_integrals
call routine
end
subroutine routine
implicit none
call save_one_e_effective_potential
call save_erf_bi_elec_integrals
end