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Removed test in reverse

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This commit is contained in:
Anthony Scemama 2019-04-10 18:55:01 +02:00
parent b086a3a33c
commit 4a99ad8252
1 changed files with 12 additions and 10 deletions
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22
src/ao_two_e_ints/map_integrals.irp.f
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@ -110,16 +110,18 @@ subroutine two_e_integrals_index_reverse(i,j,k,l,i1)
endif endif
enddo enddo
enddo enddo
do ii=1,8 ! This has been tested with up to 1000 AOs, and all the reverse indices are
if (i(ii) /= 0) then ! correct ! We can remove the test
call two_e_integrals_index(i(ii),j(ii),k(ii),l(ii),i2) ! do ii=1,8
if (i1 /= i2) then ! if (i(ii) /= 0) then
print *, i1, i2 ! call two_e_integrals_index(i(ii),j(ii),k(ii),l(ii),i2)
print *, i(ii), j(ii), k(ii), l(ii) ! if (i1 /= i2) then
stop 'two_e_integrals_index_reverse failed' ! print *, i1, i2
endif ! print *, i(ii), j(ii), k(ii), l(ii)
endif ! stop 'two_e_integrals_index_reverse failed'
enddo ! endif
! endif
! enddo
end end