Subject: G94: Out of memory in l303

From: [email-masked] (Grzegorz Bakalarski)
Date: Mon, 19 Feb 96 15:55:06 +0100

Dear Netters,
 
I am quite new in using G94. So maybe it is a FAQ ... .
I have a system with 138 basis functions. (H2O...ZN2+)
and I use 6-311(2df,2pd) basis set. Until I request
at least 10MW memory (%Mem=6 000 000), I get a   
message: 
 
(Enter /scratch/gaussian_OSF1/g94/l303.exe) 
 DipDrv:  MaxL=1. 
 Out of memory in DipPsm. 
 Error termination via Lnk1e in /scratch/gaussian_OSF1/g94/l303.exe. 
 
In G94 User Reference I found that l303 calculates multipole integrals.
 
My question are:
^^^^^^^^^^^^^^^
1) What are these "multipole integrals"Remote server has closed connection
2) Is there any way to force Gaussian to use smaller amount of memory ?
( I tried SCF=DIRECT or SCF=CONVENTIONAL or INT=NoRaffinetti and other options )

Thak for nay help. I will summarize if there will be any interest .

Grzegorz Bakalarski
Warsaw University
[email-masked]