Alex Granovsky
gran@classic.chem.msu.su
it is still here in $guess. It simply is not printed out in the listing.
Regards,
Alex Granovsky
On Fri Dec 24 '10 11:23pm, Alexandr wrote
-----------------------------------------
>Hi,
>Why in the listing output file in the text
>-------------------------------------------------- -
>GUESS OPTIONS
>-------------------------------------------------- -
>does not appear KDIAG = 0, although the input file, this command I am asking explicitly?
>Checking the correctness of the group $GUESS command exetyp=check shows that "check shows $GUESS GROUP SYNTAX IS OK". And given the available: GUESS, MIX, TOLZ, NORB, PRTMO, TOLE, NORDER and SYMDEN. And there is no mention KDIAG!
>(As we know from the mannual in this group by default KDIAG = 3) ...
>Is this team in this group is ignored?
>regards,
>Alexandr