Subject: CI calculations of CuO

From: [email-masked]
Date: Fri, 14 Jun 2002 12:54:50 -0500 (CDT)

SORRY EVERYONE ABOUT THE ATTACHMENTS. HERE THEY ARE.
     THANKS AGAIN.

COREY RICE
SIUE
CHEMISTRY DEPT.
[email-masked]
%mem=210Mb
#p UCI=(TransitionDensities,maxcycle=800,NStates=50)/6-311G(d) 
 FormCheck=(All) Pop=(NPA,Regular)
scf=(QC,maxcycle=800) IOp(9/40=5)
 
> from cuo
 
    0    2
O 0   -1.013351   -0.285889    0.293335
Cu 0    1.013336    0.285889   -0.293320