Feff: Difference between revisions

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* Follow the instructions contained in the INSTALL.md file. Mind that you may need some libraries.  
* Follow the instructions contained in the INSTALL.md file. Mind that you may need some libraries.  


* Go back to [[EXAFS|this page]] to check that the program is working well.  
* Go back to [[EXAFS|this page]] and do '''Pre-processing''' and '''Processing''' to check that the program is working well.


==Instalation Procedure 2==
==Instalation Procedure 2==
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     sudo cp -pr local_install/include/* /usr/local/include/.
     sudo cp -pr local_install/include/* /usr/local/include/.


* Go back to [[EXAFS|this page]] to check that the program is working well.
* Go back to [[EXAFS|this page]] and do '''Pre-processing''' and '''Processing''' to check that the program is working well.
 
==Still not working?==
 
If you are still wasting time with unsucessfull instalation, you can use a special account Rodrigo created for everybody:
$ ssh exafs@10.0.7.25 # Ask Rodrigo for the password.
$ cd ~/feff85exafs-master/tests/youruser
* Go back to [[EXAFS|this page]] and do '''Pre-processing''' and '''Processing''' to check that the program is working well.

Revision as of 13:40, 28 February 2019

go back to Main Page, Group Pages, Núria López and Group, Scripts_for_VASP, Computational Resources, EXAFS

Program feff8l is part of the simulation of EXAFS spectra. The input files, feff.inp, can be generated from *cif files in this webpage http://millenia.cars.aps.anl.gov/webatoms/. The output can be analyzed with Athena.

Instalation Procedure 1

  • Follow the instructions contained in the INSTALL.md file. Mind that you may need some libraries.
  • Go back to this page and do Pre-processing and Processing to check that the program is working well.

Instalation Procedure 2

  • Instead of following INSTALL.md instructions, you only need to run this:
   sudo cp -pr local_install/bin/* /usr/local/bin/.
   sudo cp -pr local_install/lib/* /usr/local/lib/.
   sudo cp -pr local_install/include/* /usr/local/include/.
  • Go back to this page and do Pre-processing and Processing to check that the program is working well.

Still not working?

If you are still wasting time with unsucessfull instalation, you can use a special account Rodrigo created for everybody:

$ ssh exafs@10.0.7.25 # Ask Rodrigo for the password. 
$ cd ~/feff85exafs-master/tests/youruser
* Go back to this page and do Pre-processing and Processing to check that the program is working well.