Rationalizing the effect of shape and size in nanoparticle-based glues
File(s)acs.jpcc.2c00461.pdf (4.91 MB)
Published version
Author(s)
Xie, Kaiye
Gao, Xiaoxin
Xiao, Chengcheng
Molinari, Nicola
Angioletti-Uberti, Stefano
Type
Journal Article
Abstract
Recent experimental efforts have investigated nanoparticle solution as glues for hydrogels, focusing on the role of nanoparticle size and shape in influencing adhesion. Here, we use molecular dynamics simulations together with a coarse-grained model and consider a variety of different nanoparticle morphologies to expand on these experiments. Our main result is to show that while nanoparticles’ shape and size can play an important role, whether and how much these two factors affect adhesion strongly depend on the amount of nanoparticles loaded at the interface, as well as on the mutual interaction between the nanoparticles. Furthermore, we suggest that the nanoparticle gluing performance can be qualitatively understood in terms of the relationship between the shape and surface curvature, with lower curvature shapes providing, for different reasons, stronger adhesion in a wider range of nanoparticle loading.
Date Issued
2022-05-05
Date Acceptance
2022-04-15
Citation
The Journal of Physical Chemistry C: Energy Conversion and Storage, Optical and Electronic Devices, Interfaces, Nanomaterials, and Hard Matter, 2022, 126 (17), pp.7517-7528
ISSN
1932-7447
Publisher
American Chemical Society
Start Page
7517
End Page
7528
Journal / Book Title
The Journal of Physical Chemistry C: Energy Conversion and Storage, Optical and Electronic Devices, Interfaces, Nanomaterials, and Hard Matter
Volume
126
Issue
17
Copyright Statement
Copyright © 2022 The Authors. Published by American Chemical Society. This work is published under a CC BY licence.
License URL
Identifier
https://www.webofscience.com/api/gateway?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000814854000018&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=a2bf6146997ec60c407a63945d4e92bb
Subjects
Science & Technology
Physical Sciences
Technology
Chemistry, Physical
Nanoscience & Nanotechnology
Materials Science, Multidisciplinary
Chemistry
Science & Technology - Other Topics
Materials Science
IN-SILICO
INHIBITION
ADHESIVES
HYDROGELS
DYNAMICS
Publication Status
Published
Date Publish Online
2022-04-21