g94 problem
Hi,
Is there anyone who knows the solution to the following problem ?
I have just started to calculate with the Gaussian 94 package.
I am trying to run a Gaussian 94 job.
After a while, the program aborts, leaving me with the following
sentence :
Requested convergence on MAX density matrix=1.00D-06.
Integral accuracy reduced to 1.0D-05 until final iterations.
Problem detected with inexpensive integrals.
Switching to full accuracy and repeating last cycle.
Warning! Spurious integrated density:
NE= 192 Integral= 192.25168 Tolerance=1.00D-03
Consistency failure #2 in CalDSu.
Error termination via Lnk1e in
/usr/local/programs/gaussian/g94/l502.exe.
Job cpu time: 0 days 0 hours 22 minutes 27.3 seconds.
File lengths (MBytes): RWF= 423 Int= 0 D2E= 0 Chk= 4 Scr=
1
Can somebody help me with this ?
Thanks in advance,
Jeffrey X Z
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