help
Dear Folks,
I am an earlier Gaussian programms, I carried out at the ab initio hf/3-21g
Level. It has 210 Basis Function. And I had gotten an error like that:
Erroneous write. write -1 instead of 4096
File system characteristics:
Fragment size =0
Total blocks =4002240
Free blocks =2744299
Job blocks max=204800
File characteristics:
File descriptor=7
Words to extend=27136
out2e will use a cutoff of 1.00E-10
Standard cutoffs selected in Shell.
error termination in lnk1e.
And my input file was :
# USER=concha
# QSUB -r big
# QSUB -s /bin/sh
# QSUB -lm 4Mw
# QSUB -lM 4Mw
# QSUB -lt 25300
# QSUB -lT 25400
# QSUB -q standby
#
ja
set -x
cd $TMP
cfs get check.chk
date
#
cat > big.dat << EOF
%chk=big.chk
#N HF/3-21G OPT NAME=MONICA
big
0,1
Z-MATRIX.......
Any help you can provide will be greatly appreciated.
Please send responses directly to me.
Monica Concha
Dept. of Chemistry
University of New Orleans
New Orleans LA 70148
Email: Bitnet%"mcccm (+ at +) uno"