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- From: <chona00@gmail.com>
- To: forum@abinit.org
- Subject: [abinit-forum] cut3d cannot read density file
- Date: Thu, 17 Apr 2008 22:46:09 +0200
Hi,
I'm trying to familiarize myself with cut3d, but I encounter an error when
I
read in the density file produced by the first dataset in the tutorial on
analysis tools (using t35.in as input):
1 => Your file contains unformatted binary header + 3D data
The information it contains should be sufficient.
cut3d : read file out from unit number 19.
===============================================================================
ECHO of the ABINIT file header
First record :
.codvsn,headform,fform = @***** 0
Second record :
bantot,intxc,ixc,natom =****** 127****** 127
ngfft(1:3),nkpt = 0 10 0******
nsppol,nsym,ntypat,occopt=****** 127****** 42
ecut_eff = 9.0367904611-313
rprimd(1:3,1) = 9.0367294141-313 2.7108495913-312
0.0000000000E+00
rprimd(1:3,2) = 2.7108495867-312 1.2049684800-312
0.0000000000E+00
rprimd(1:3,3) = 3.3295162924-317 2.7108495913-312
1.2049738821-312
Third record :
**** Segmentation fault! Fault address: (nil)
This is likely to have been caused by either a null pointer dereference or a
general protection fault.
Aborted
Searching the archives for a similar error did not yield anything so this
looks
like a problem unique to me. I'm not sure how I can enclose an attachment,
but
I can provide the density file upon request.
Thanks,
Chona
- [abinit-forum] cut3d cannot read density file, chona00, 04/17/2008
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