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- Tue Oct 30, 2012 7:37 pm
- Forum: Bader
- Topic: sel_atom problems
- Replies: 1
- Views: 12408
sel_atom problems
Hi, I use the following command: ~/Physics/vasp/bader -p sel_atom 1-3 CHGCAR_diff and I get the files BCF.dat, AVF.dat, and ACF.dat, however I don't see any volumes output which is why I set the sel_atom flag. BCF.dat head looks like: # X Y Z CHARGE ATOM DISTANCE ...