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E. McNellis

6 papers hereh-index 131.3k citations27 works total

Matching runs newest-first, so older work may not be attached to this profile yet.

author position
  • first author4
  • middle author2

Across the 6 of 6 papers where every author was matched, so the position is known.

fields
  • cond-mat.mtrl-sci5
  • physics.app-ph1

identity via Semantic Scholar / OpenAlex

activity
20092020
most citedAzobenzene at Coinage Metal Surfaces: The Role of Dispersive van der Waals Interactions

554 citations · 828 across the 6 of their papers we have counts for

collaborators
Showing 2009Show all

2 papers · 1 filter

cond-mat.mtrl-sci2009★ 554 cited

Azobenzene at Coinage Metal Surfaces: The Role of Dispersive van der Waals Interactions

Erik McNellis, Jorg Meyer, Karsten Reuter

We use different semi-empirical dispersion correction schemes to assess the role of long-range van der Waals interactions in the adsorption of the prototypical molecular switch azo…

cond-mat.mtrl-sci2009★ 54 cited

Stabilizing a Molecular Switch at Solid Surfaces: A Density-Functional Theory Study of Azobenzene at Cu(111), Ag(111), and Au(111)

Erik McNellis, Jorg Meyer, Abbas Dehghan Baghi +1

We present a density-functional theory trend study addressing the binding of the trans-cis conformational switch azobenzene (C6H5-N=N-C6H5) at three coinage metal surfaces. From th…

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