Probing the conformational energetics of alkyl thiols on gold surfaces by means of a morphing/steering non-equilibrium tool
Author:
Affiliation:
1. Dipartimento di Scienze Chimiche
2. Università degli Studi di Padova
3. I-35131 Padova
4. Italy
Abstract
Jarzynski's equality is applied to compute the torsion free energy, bond-by-bond, for a probe alkyl thiol tethered to a gold surface.
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2015/CP/C4CP05505E
Reference33 articles.
1. Self-assembled monolayers of alkanethiols on Au(111): surface structures, defects and dynamics
2. Self-assembled monolayers of thiols and dithiols on gold: new challenges for a well-known system
3. The Chemistry of the Sulfur–Gold Interface: In Search of a Unified Model
4. The gold–sulfur interface at the nanoscale
5. Lanthanide-Based NMR: A Tool To Investigate Component Distribution in Mixed-Monolayer-Protected Nanoparticles
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