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Merge pull request #233 from Ydrnan/qp2_add
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bugfix in restore_symmetry
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Anthony Scemama 2023-01-18 09:22:44 +01:00 committed by GitHub
commit a317506294
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src/utils/linear_algebra.irp.f
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@ -1735,6 +1735,7 @@ subroutine restore_symmetry(m,n,A,LDA,thresh)
! enddo ! enddo
! Symmetrize ! Symmetrize
i = 1
do while( (i < sze).and.(-copy(i) > thresh) ) do while( (i < sze).and.(-copy(i) > thresh) )
pi = i pi = i
pf = i pf = i