[Pw_forum] epsilon.x

[Axel Kohlmeyer]

On Tue, 22 Jul 2008, T t wrote:

TT> dear pwscf users,

dear thierry,

TT> has some of you calculated the dielectric function within pwscf? I 
TT> am struggling with a pb i haven't managed to fix yet, and i hope you 
TT> will help me. According to the document eps_man.pdf, the dielectric 
TT> function is calculated as a normal postprocessing that uses the 
TT> executable epsilon.x and gives in output a file termed epsr(i).dat. 
TT> In my case, the epsilon.x runs well but doesn't produce any file in 
TT> output. is there a problem inside the epsilon.x code? How to make it 
TT> write the outputs on the working directory?

since nobody here can read your mind (or that of your computer),
please provide example files so that people can try to reproduce
your problems. without proof to the contrary, one has to assume
that you have made an error in your input(s).

cheers,
   axel.


TT> many thanks in advance.
TT> Thierry
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-- 
=======================================================================
Axel Kohlmeyer   akohlmey at cmm.chem.upenn.edu   http://www.cmm.upenn.edu
   Center for Molecular Modeling   --   University of Pennsylvania
Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323
tel: 1-215-898-1582,  fax: 1-215-573-6233,  office-tel: 1-215-898-5425
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If you make something idiot-proof, the universe creates a better idiot.