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Re: [abinit-forum] Bug when trying to merging ddb files .


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  • From: "Sanjay D. Gupta" <guptasanjay.56@gmail.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] Bug when trying to merging ddb files .
  • Date: Thu, 1 Apr 2010 07:00:39 +0530
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Dear Abinit Users
i miss to attach log and other ddb files
i am attching the log and tar file containing the ddb files..

Sanjay





Science is a great game. It is inspiring and refreshing. The playing field is the universe itself.
...........................................................
Sanjay D. Gupta
Junior Research Fellow
DST (Indo-Russia) Project,
Department of Physics,
Bhavnagar University, Bhavnagar-364 022
Gujarat,
Mobile-9879666643
email:guptasanjay_56@yahoo.co.in
...........................................................


On Thu, Apr 1, 2010 at 6:55 AM, sanjaykumar durgaprasad gupta <guptasanjay.56@gmail.com> wrote:

Dear Abinit Users,

I got the Bug when trying to mrgddb files .
at the end of log file the message is



inprep8 : open file GdNo_DS3_DDB
inprep8 : nband(1)= 16
-0.35714285714286D+00 0.50000000000000D+00 0.71428571428571D-01
-0.28571428571429D+00 0.50000000000000D+00 0.14285714285714D+00
-0.21428571428571D+00 0.50000000000000D+00 0.21428571428571D+00
-0.14285714285714D+00 0.50000000000000D+00 0.28571428571429D+00
-0.71428571428571D-01 0.50000000000000D+00 0.35714285714286D+00
0.50000000000000D+00 -0.42857142857143D+00 0.00000000000000D+00
inprep8 : BUG -
Error when reading the psp information
String= -
Action : contact ABINIT group.

.Delivered 0 WARNINGs and 0 COMMENTs to log file.

leave_new : decision taken to exit ...

++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++


i am attaching my log file and the correspong ddb files.

Hoping for Positive Reply

Sanjay D Gupta

Attachment: mrglog
Description: Binary data

Attachment: DDB-files.tar.gz
Description: GNU Zip compressed data




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