DFTB problems with mio-1-1 parameter set

[terra... at gmail.com]

Hi
Thanks very much for your help. It does fix the problem! What about the 
X-Y.skf file when X=Y, e.g. in file O-O.skf, the fourth line reads 20*1.0 
also, do we keep it as it is? 
BTW, it will be great if someone can redirect me to some materials that 
explains the format of dftb parameter files.

Best Regards
Jiasen Guo
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