Hello there,
I have been running DOS calculations for magnetic systems, (with LORBIT=11), and using the split_dos code to perform site projections.
If I print out the total DOS from the DOS0 file, I find that it does not equal that which I get from the sum of the DOS data from the separate atoms ...
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- Thu Dec 10, 2015 8:23 pm
- Forum: VTSTTools
- Topic: split-dos site projection issue
- Replies: 1
- Views: 10124