[Wien] ifort 12.0.2 20110112 -- safe?

[Peter Blaha]

The latest version of ifort  (composerxe-2011.1.107) fixed the problem in SRC_lstart/insld.f
(discussed in the mailing list).

However, there is still an -O problem in   SRC_lapwso/garadme.f,   which
can be fixed either with -O1 or with a fix like:
...
       DO 200 L=0,lomax
       if (loor(l,ity)) then
         LK=L+1
         DO 204 IC=1,1
         DO 206 IR=1,JRI
           if(isi.eq.isj)then
             vde=vder(ir,isi)
           else
             vde=(vder(ir,isi)+vder(ir,isj))/2.
           endif
if(ir.eq.1.and.l.eq.lomax) write(882,*) ir   ! stupid fix for ifort12 bug
...
       do l=0,lomax
         if (loorext(l,ity)) then
           lk = l+1
           do ic=1,1
             do ir = 1,jri
               if (isi.eq.isj) then
                 vde = vder(ir,isi)
               else
                 vde = (vder(ir,isi)+vder(ir,isj))/2.
               endif
if(ir.eq.1.and.l.eq.lomax) write(882,*) ir   ! stupid fix for ifort12 bug


Otherwise I have no problems (but might not have run all utility programs yet).

Am 21.03.2011 22:51, schrieb Laurence Marks:
> Does anyone know if the ifort 12 bugs have been sorted out?
>

-- 

                                       P.Blaha
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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