Subject: RE: G3 with G98W

From: "Shobe, Dave" <[email-masked]>
Date: Thu, 14 Feb 2002 09:34:54 -0500

I got the idea yesterday of restarting the "crashed" G3 job (which had
proceeded up to the point where it needed the G3Large basis set) with the
route "#n g3=restart extrabasis".  Even this does not work:

 Symmetry turned off:
 Atomic calculation.
 Stoichiometry    Br(2)
 Framework group  KH  
 Deg. of freedom    0
 Full point group                 KH      NOp   1
 Standard basis: GTLarge (5D, 7F)
 Atomic number out of range in G3lBas.
 Error termination via Lnk1e in C:\G98W\l301.exe.
 Job cpu time:  0 days  0 hours  0 minutes  1.0 seconds.
 File lengths (MBytes):  RWF=    6 Int=    0 D2E=    0 Chk=    2 Scr=    1

--David Shobe
Süd-Chemie Inc.
phone (502) 634-7409
fax     (502) 634-7724
email  [email-masked]

Don't bother flaming me: I'm behind a firewall.