[molpro-user] save optimization information

[Dr Seth OLSEN]

Hi Molpro-users,

I would like to second this point.  My jobs to exactly the same thing
when I attempt to use the save directive under OPTG.  In fact, it
finishes with exactly the same error.  This has cost me hours of work
today to try and mess with, to no avail.  What is the problem?

My multi deck:

mcscf
occ,64
closed,62
state,2
weight,1,1
cpmcscf,grad,2.1
optg,gaussian,maxit=5
start,700
save,710

the error reads:


 GEOMETRY RECORD   710 NOT FOUND
 CURRENT STACK:      MAIN



Cheers,

Seth

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Dr Seth Olsen, PhD
Postdoctoral Fellow, Computational Systems Biology Group
Centre for Computational Molecular Science
Chemistry Building,
The University of Queensland
Qld 4072, Brisbane, Australia

tel (617) 33653732
fax (617) 33654623
email: s.olsen1 at uq.edu.au
Web: www.ccms.uq.edu.au 

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----- Original Message -----
From: liuxj at iccas.ac.cn
Date: Tuesday, June 21, 2005 5:12 pm
Subject: [molpro-user] save optimization information
> Dear all
> I wanna save optimization information in a record to use in a 
> subsequentoptimization
> but it failed
> here is the .out
> I don't know what's with my input
> any advuces are wekcome 
> 
> Liu Xiaojun
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