[Wien] Port option of mini

Michael Gurnett michael.gurnett at kau.se
Wed Aug 11 20:15:45 CEST 2004


I have included the case.outputM file (I was lazy so it really was called 
case). The force tolerance is set to 1. The calculations are using 12 
k-points for this system and the Rmt are 2.25 for both the Ge and Li atoms.
 
Hope you can help
 
Michael
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