[ase-users] Bug and patch for reading EON .con files

[Tobias Brink]

Hello!

I noticed a bug when reading .con files produced by EON: The masses of 
the atoms were assigned incorrectly. I attached a patch for 
ase/io/eon.py. I would have submitted a bug, but it seems I need to be 
logged into trac to do that. I couldn't find how to get an account, did 
I miss something?

The patch also changes the function for writing .con files to match the 
way EON does it. Most importantly, the indices of the atoms were wrong. 
As far as I can see from the EON source code, the indexing bug was not 
harmful because EON actually ignores the indices when reading these 
files. So this change is more cosmetic, feel free to include or ignore.

Regards,

Tobias

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