Dear all,
First of all, I would like to thank you for this great forum.
I am interested to plot the charge density difference for a molecule adsorbed on metal slabs. In order to do that, I write a fortran code inspired from your script chargdiff.pl. The code is doing the difference as follow ...
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- Sat Aug 27, 2011 8:29 pm
- Forum: VTSTTools
- Topic: CHGCAR difference for adsorbed molecules on slabs
- Replies: 0
- Views: 13376