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Added tests for AOs
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src/AOs/tests/test_overlap.irp.f
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12
src/AOs/tests/test_overlap.irp.f
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program test_normalization
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implicit none
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integer :: i,j
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character*(64), parameter :: f = '(i3.3,a,i3.3,a3,F12.8)'
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do j=1,ao_num
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do i=1,ao_num
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if (abs(ao_overlap(i,j)) > 1.d-6) then
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print f, i,'_',j, ' : ', ao_overlap(i,j)
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endif
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enddo
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enddo
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end
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src/AOs/tests/test_overlap.ref
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93656
src/AOs/tests/test_overlap.ref
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