[Wien] Error in nn of a supercell

Torsten Andersen thor at physik.uni-kl.de
Tue Nov 4 15:52:53 CET 2003


x_lapw -d nn
nn nn.def

assuming your path is correctly set up.

Best regards,
Torsten Andersen.

panzhijun2002 at sjtu.edu.cn wrote:

>Hi,everyone:
>   After creating a supercell for original CoSi.struct,nn command is performed in the command line.Later on,error follows.The error information is as follows:
>   please specify nn-bondlength factor: (usually=2)
>   ERROR IN OPENING NN.DEF !!!!
>   FORTRAN STOP NN.DEF
>
> How to solve this problem?Please help me.Thank you very much.
> 
>




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