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Re: [abinit-forum] Can I calculate Raman properties of graphite or CNTs ?


Chronological Thread 
  • From: "张�s" <zhangting1980323@gmail.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] Can I calculate Raman properties of graphite or CNTs ?
  • Date: Mon, 24 Nov 2008 13:55:49 +0800
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Thanks!

2008/11/23 Frank Grosse <frank.grosse@physik.hu-berlin.de>
Dear Zhang Ting,
the bug report sounds like as if abinit could not find the input wavefunction file. Checking your input file (diff helps), I guess that

...
get1wfk5 4
...

should replaced by
...
get1wf5 4
...

as in the tutorial.

Regards

Frank Grosse

============================================
Dr. Frank Grosse
Humboldt-Universität zu Berlin
Institut für Physik
AG Festkörpertheorie
Newtonstraße 15
D-12489 Berlin
Tel. +49-30-20934993
email Frank.Grosse@physik.hu-berlin.de






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