Accurately extracting the signature of intermolecular interactions present in the NCI plot of the reduced density gradient versus electron density | NobleBlocks
Public
Accurately extracting the signature of intermolecular interactions present in the NCI plot of the reduced density gradient versus electron density
N
Shared by NobleBlocks on Jan 1, 2017 • 12:00 AM UTC
Authors:
Corentin Lefebvre
,
Gaëtan Rubez
,
Hassan Khartabil
Abstract
A new model for reference electron densities, really getting rid of interactions.
