The ABINIT Users Mailing List ( CLOSED )

[Latévi Max LAWSON DAKU <Max.Lawson@unige.ch>]

Dear ABINIT users and developers

I am trying to determine the irreps of phonons at Gamma
with the "get_irreps.py" utility, available in ~/ABINIT4.6.5/Utilities.
However, this does not work: the script fails while trying to get
info from  www.cryst.ehu.es, as shown below.

>>

max# ./get_irreps.py Z.out Z.anaddb.out
225
http://www.cryst.ehu.es/cgi-bin/cryst/xml/nph-get_doc?p=irreps&g=225&k=0,0,0,GM,p

Traceback (most recent call last):
  File "./get_irreps.py", line 492, in ?
   
bilbao_irreps_names,bilbao_irreps_chars=get_irreps_chars(chardom,len(bilbao_sym_elem))
  File "./get_irreps.py", line 85, in get_irreps_chars
    nirreps = irreps_node[0].getAttribute('num')
IndexError: list index out of range

>>

I do not know how to debug this script. Any suggestion or idea is
welcome.

Please attached find: the abinis output file (Z.out) and the anaddb
output files (Z.anaddb.out).


Best regards,
Max



-- 
***********************************************
Latevi Max LAWSON DAKU
Departement de chimie physique 
Universite de Geneve - Sciences II
30, quai Ernest-Ansermet  
CH-1211 Geneve 4 
Switzerland 

Tel: (41) 22/379 6548 ++ Fax: (41) 22/379 6103
***********************************************

Attachment: Z.anaddb.out.gz
Description: application/gzip

Attachment: Z.out.gz
Description: application/gzip