PC GAMESS-related discussion club

Damodaran Krishnan
damodak@pitt.edu

I am not able to run DFT calculations in parallel. When I run it without "-np 2" it runs fine. But with "-np 2" the run gets killed immediately. Here is my input, is there anything wrong?


$CONTRL SCFTYP=RHF RUNTYP=OPTIMIZE DFTTYP=B3LYP UNITS=ANGS COORD=ZMT $END
$STATPT NSTEP=9000 $END
$SYSTEM IDLE=.T. MKLNP=2 $END
$P2P P2P=.T. DLB=.T. $END
$SCF DIRSCF=.True. $END
$GUESS GUESS=HUCKEL $END
$BASIS GBASIS=N21 NGAUSS=3 $END
$DATA


thanks
Damodaran