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examples_configurations [2013/08/15 15:20] – add more examples danielexamples:configurations [2018/01/10 17:29] (current) daniel
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 ====== Example : Configuration file ====== ====== Example : Configuration file ======
 ---- ----
-Configuration files can be created very easily with the [[Utilities#vasp2force|vasp2force]] script. +Configuration files can be created very easily with the [[utilities:vasp2force|vasp2force]] script. 
  
 ===== Single configuration ===== ===== Single configuration =====
  
 A simple configuration file with only one atomic configuration:  A simple configuration file with only one atomic configuration: 
-<code config.simple>+<code potfit config.simple>
  #N 4 1  #N 4 1
  #C Al  #C Al
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 </code> </code>
  
-===== Multiple configuration =====+===== Multiple configurations =====
  
 A configuration file containing two atomic configurations: A configuration file containing two atomic configurations:
-<code config.simple_2>+<code potfit config.simple_2>
 #N 4 1 #N 4 1
 #C Al #C Al
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 </code> </code>
  
-===== Many configuration =====+===== Many configurations =====
  
-All steps from an ab-initio relaxation run: {{config.MD}}+All steps from an ab-initio relaxation run: {{:config.md}}
  
 ---- ----
  
-Very basic example for a potfit run with analytic potentials: {{example_al.tar.gz}}+Very basic example for a potfit run with analytic potentials: {{:example_al.tar.gz}}
  
examples/configurations.1376572802.txt.gz · Last modified: 2013/08/15 15:20 by daniel