Viewing all changes in revision 622.
- Committer: Alberto Garcia
- Date: 2016-11-24 14:00:33 UTC
- Revision ID: albertog@icmab.es-20161124140033-j0fn8uwc6ei9gvef
Add two more files to Denchar output in 3D mode
For spin-polarized calculations, Denchar now outputs
two more files:
SystemLabel.RHO.cube: Total charge density (sum over spins)
SystemLabel.UPminusDOWN.cube: UP-DOWN spin difference
For spin-polarized calculations, Denchar now outputs
two more files:
SystemLabel.RHO.cube: Total charge density (sum over spins)
SystemLabel.UPminusDOWN.cube: UP-DOWN spin difference
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