forum@abinit.org
Subject: The ABINIT Users Mailing List ( CLOSED )
List archive
- From: Masayoshi Mikami <mmikami@rc.m-kagaku.co.jp>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] A problem for ABINIT-5.1.4
- Date: Mon, 4 Sep 2006 10:03:11 +0900
Dear Lo,
I forgot to include the URL of "Problem Report". My bad.
http://www.abinit.org/community/?text=bug_report
Still, we could not realize what is going on there.
Your problem is related to "abinip" (parallel) only ?
or you still have the problem with "abinis" (sequential) ?
How about information about the platform you use ?
(possibly, the system memory might not be sufficient ?)
If the log file is not so long, you could attach the log file
(gzipped format might be preferred, if the log is long...)
Please peruse the "Problem Reports", before posting.
(see also, http://www.abinit.org/community/?text=netiquette)
Thanks.
Regards,
Masayoshi
On 2006/09/03, at 14:56, septhiroth0629@hotmail.com wrote:
Dear all
First thank for Masayoshi suggest.
This is my input file:
localrdwf 1
occopt 1
diemac 1.0
diemix 0.5
ixc 7
natfix 2
iatfix 1 2
ionmov 3
optcell 1
ntime 100
dilatmx 1.1
acell 3*15
rprim 1.0 0.0 0.0
0.0 1.0 0.0
0.0 0.0 1.0
chkprim 0
nkpt 1
ecut 35.0
ecutsm 0.5
nline 30
nstep 200
toldfe 1.0d-6
tolmxf 5.0d-4
natom 2
nband 6
ntypat 1
typat 2*1
xcart 9.676 7.5 7.5
5.0 7.5 7.5
znucl 13
This is an Al cluster.
The error in log file is:
Error encountered while attempting to allocate a data object. The program
will stop.
Is there any problems in my input file?
Thank for help
W.C Lo
- [abinit-forum] A problem for ABINIT-5.1.4, septhiroth0629, 09/02/2006
- Re: [abinit-forum] A problem for ABINIT-5.1.4, Bruno Siberchicot, 09/11/2006
- <Possible follow-up(s)>
- Re: [abinit-forum] A problem for ABINIT-5.1.4, mmikami, 09/02/2006
- Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, septhiroth0629, 09/03/2006
- Re: [abinit-forum] A problem for ABINIT-5.1.4, Masayoshi Mikami, 09/04/2006
- Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, septhiroth0629, 09/04/2006
- Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, Yong Liu, 09/04/2006
- Re: Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, dylu, 09/04/2006
- Re: Re: Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, septhiroth0629, 09/07/2006
- Re: Re: Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, Anglade Pierre-Matthieu, 09/07/2006
- Re: Re: Re: Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, septhiroth0629, 09/13/2006
- Re: Re: Re: Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, Anglade Pierre-Matthieu, 09/13/2006
- Re: Re: Re: Re: Re: Re: [abinit-forum] A problem for ABINIT-5.1.4, septhiroth0629, 09/13/2006
Archive powered by MHonArc 2.6.16.