[Pw_forum] a small problem

贺伟 weihe at mail.ustc.edu.cn
Sat Dec 27 07:51:49 CET 2003


 
Dear all:

     Happy new year!

     Now I have a small problem.When I run pw.x to make a relax calculation,in the
fourth step of geometry relaxation, there is an error message :

     linmin: 3rd order interpolation

 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     from linmin : error #         2
     unexpected error
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     stopping ...
	
Would somebody tell me  the possible  reason for this error? Thanks!
         
 
Best Wishes
Wei He 				

        
      


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