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Merge pull request #227 from Ydrnan/qp2_add
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typo doc rohf
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Anthony Scemama 2022-12-08 16:13:50 +01:00 committed by GitHub
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src/scf_utils/fock_matrix.irp.f
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@ -15,7 +15,7 @@
!
! Rcc = Acc Fcc^a + Bcc Fcc^b
! Roo = Aoo Foo^a + Boo Foo^b
! Rcc = Avv Fvv^a + Bvv Fvv^b
! Rvv = Avv Fvv^a + Bvv Fvv^b
! Fcv = (F^a + F^b)/2
!
! F^a: Fock matrix alpha (MO), F^b: Fock matrix beta (MO)