Physics – Condensed Matter – Materials Science
Scientific paper
2009-01-14
PMC Physics B 2008, 1:16
Physics
Condensed Matter
Materials Science
12 pages, 6 figures
Scientific paper
10.1186/1754-0429-1-16
Evolution of structure of spherical SiO2 nanoparticles upon cooling from the melt has been investigated via molecular-dynamics (MD) simulations under non-periodic boundary conditions (NPBC). We use the pair interatomic potentials which have weak Coulomb interaction and Morse type short-range interaction. The change in structure of SiO2 nanoparticles upon cooling process has been studied through the partial radial distribution functions (PRDFs), coordination number and bond-angle distributions at different temperatures. The core and surface structures of nanoparticles have been studied in details. Our results show significant temperature dependence of structure of nanoparticles. Moreover, temperature dependence of concentration of structural defects in nanoparticles upon cooling from the melt toward glassy state has been found and discussed.
Hoang Zung
Nguyen Huynh T. X.
Vo Hoang V.
No associations
LandOfFree
Evolution of structure of SiO2 nanoparticles upon cooling from the melt does not yet have a rating. At this time, there are no reviews or comments for this scientific paper.
If you have personal experience with Evolution of structure of SiO2 nanoparticles upon cooling from the melt, we encourage you to share that experience with our LandOfFree.com community. Your opinion is very important and Evolution of structure of SiO2 nanoparticles upon cooling from the melt will most certainly appreciate the feedback.
Profile ID: LFWR-SCP-O-375715