fepc_au
FePc/Au(111)
Created with FHI-AIMS hybrid functional B3LYP XC-functional on 1 Au layer. This test is an example, how the PP-IETS simulations can be done.
!!! BEWARE: This is not exactly the same results as in PRL 119, 166001 (2017), since there was used electrostatics for the PP-AFM precalculations !!!
Example: All_0.0_Fermi_none_0.06.png
fepc_au.txt · Last modified: 2018/10/24 13:35 by krejcio
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