Thermodynamics of the physisorption of capping agents on silver nanoparticles

Author:

Zúñiga-Bustos Matías1ORCID,Comer Jeffrey2ORCID,Poblete Horacio34ORCID

Affiliation:

1. Programa Institucional de Fomento a la Investigacion, Desarrollo e Innovacion (PIDi), Universidad Tecnologica Metropolitana, Santiago 8940577, Chile

2. Department of Anatomy and Physiology, Kansas State University, Manhattan, 66506-580, Kansas, USA

3. Center for Bioinformatics and Molecular Simulation, Facultad de Ingenieria, Universidad de Talca, 2 Norte 685, Talca, Chile

4. Millennium Nucleus of Ion Channel-Associated Diseases (MiNICAD), Talca, Chile

Abstract

Molecular dynamics simulations show that thiol-containing capping agents for silver nanoparticles, such as mercaptohexanol and lipoic acid, spontaneously assemble into dense aggregates at the silver–water interface.

Funder

National Science Foundation

Fondo Nacional de Desarrollo Científico y Tecnológico

Ministerio de Ciencia, Tecnología, Conocimiento e Innovación

Agencia Nacional de Investigación y Desarrollo

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

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