Skip to Content.
Sympa Menu

forum - how to solve this problem resulting from phonon calculation

forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

how to solve this problem resulting from phonon calculation


Chronological Thread 
  • From: chaohao.mse@gmail.com
  • To: forum@abinit.org
  • Subject: how to solve this problem resulting from phonon calculation
  • Date: Mon, 26 Nov 2007 09:39:12 +0100

Dear abiniters,

After perfoming the test about response functions (RF) calculations, I return
to my system. But I got the follwing error information when combinning all
DDB files produced from the first step calculations? How to solve this
problem? I must add some calculations on other k-points? But checking the
second lesson on RF2, I also find the nkpts from input DDB and transfer DDB
are not equal to each other. I am a newbie of abinit code. Please give me
some helps.

===============================
read the input derivative database information
read 1 blocks from the input DDB

read the input derivative database number 2
compare the current and input DDB information
chki8 : ERROR -
Comparing integers for variable nkpt.
Value from input DDB is 14 and
from transfer DDB is 27.
Action : check your DDBs.

leave_new : decision taken to exit ...
===============================

Regards,
C.H.



Archive powered by MHonArc 2.6.16.

Top of Page