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https://github.com/LCPQ/quantum_package
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Integrals goind from Write to Read
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@ -481,7 +481,7 @@ IRP_ENDIF COARRAY
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ao_bielec_integrals_in_map = .True.
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ao_bielec_integrals_in_map = .True.
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if (write_ao_integrals) then
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if (write_ao_integrals) then
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call dump_ao_integrals(trim(ezfio_filename)//'/work/ao_integrals.bin')
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call dump_ao_integrals(trim(ezfio_filename)//'/work/ao_integrals.bin')
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call ezfio_set_integrals_bielec_disk_access_ao_integrals(.True.)
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call ezfio_set_integrals_bielec_disk_access_ao_integrals("Read")
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endif
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endif
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END_PROVIDER
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END_PROVIDER
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@ -312,7 +312,7 @@ IRP_ENDIF
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if (write_mo_integrals) then
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if (write_mo_integrals) then
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call dump_mo_integrals(trim(ezfio_filename)//'/work/mo_integrals.bin')
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call dump_mo_integrals(trim(ezfio_filename)//'/work/mo_integrals.bin')
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call ezfio_set_integrals_bielec_disk_access_mo_integrals(.True.)
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call ezfio_set_integrals_bielec_disk_access_mo_integrals("Read")
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endif
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endif
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