diff --git a/sammy/src/xct/mxct30.f90 b/sammy/src/xct/mxct30.f90 index 58217d5f678952852f3006bc9471640cb63cf9d8..40491a9f8e0a052b4754d5872d2ee18a33d01177 100644 --- a/sammy/src/xct/mxct30.f90 +++ b/sammy/src/xct/mxct30.f90 @@ -95,6 +95,7 @@ end function isoMgr = spinMgr%getIsotopeIndex() IF (IsoNgr.EQ.IsoMgr) & THEN + Spinm = dABS(spinGroupMgr%getJ()) Acn2 = Acn !v IF (Mgr.NE.Ngr) THEN !v Acn2 = Two*Acn