[Wien] TELNES and problem of SO

bruce.tian brucetian8080 at gmail.com
Sat Apr 7 13:40:32 CEST 2012


Dear all:

I have two questions:

1. When I calculated the ELNES of Ni why I always get the error: 'TELNES3 -
can't open definition file����������������������������������������'. In the
whole calculation there is no other error reported.

2. In DOS calculation When I include the SO in case.outputtup it can be
found 'EMAX reduced due to lower HIGHEST BAND-minimum
 EMIN, DE, EMAX:  -0.50000   0.00200   0.45250'. The original EMAX is set
to be 3.5Ry. What is the problem? If I want to expand the energy range of
DOS what shall I do?

Thanks!
best regards
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