Please use this identifier to cite or link to this item: http://doi.org/10.25358/openscience-1915
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dc.contributor.authorDiaz Ochoa, Juan G.
dc.date.accessioned2005-09-28T09:48:54Z
dc.date.available2005-09-28T11:48:54Z
dc.date.issued2005
dc.identifier.urihttps://openscience.ub.uni-mainz.de/handle/20.500.12030/1917-
dc.description.abstractThe fundamental aim in our investigation of the interaction of a polymer film with a nanoparticle is the extraction of information on the dynamics of the liquid using a single tracking particle. In this work two theoretical methods were used: one passive, where the motion of the particle measures the dynamics of the liquid, one active, where perturbations in the system are introduced through the particle. In the first part of this investigation a thin polymeric film on a substrate is studied using molecular dynamics simulations. The polymer is modeled via a 'bead spring' model. The particle is spheric and non structured and is able to interact with the monomers via a Lennard Jones potential. The system is micro-canonical and simulations were performed for average temperatures between the glass transition temperature of the film and its dewetting temperature. It is shown that the stability of the nanoparticle on the polymer film in the absence of gravity depends strongly on the form of the chosen interaction potential between nanoparticle and polymer. The relative position of the tracking particle to the liquid vapor interface of the polymer film shows the glass transition of the latter. The velocity correlation function and the mean square displacement of the particle has shown that it is caged when the temperature is close to the glass transition temperature. The analysis of the dynamics at long times shows the coupling of the nanoparticle to the center of mass of the polymer chains. The use of the Stokes-Einstein formula, which relates the diffusion coefficient to the viscosity, permits to use the nanoparticle as a probe for the determination of the bulk viscosity of the melt, the so called 'microrheology'. It is shown that for low frequencies the result obtained using microrheology coincides with the results of the Rouse model applied to the polymer dynamics. In the second part of this investigation the equations of Linear Hydrodynamics are solved for a nanoparticle oscillating above the film. It is shown that compressible liquids have mechanical response to external perturbations induced with the nanoparticle. These solutions show strong velocity and pressure profiles of the liquid near the interface, as well as a mechanical response of the liquid-vapor interface. The results obtained with this calculations can be employed for the interpretation of experimental results of non contact AFM microscopyen_GB
dc.language.isoeng
dc.rightsInCopyrightde_DE
dc.rights.urihttps://rightsstatements.org/vocab/InC/1.0/
dc.subject.ddc530 Physikde_DE
dc.subject.ddc530 Physicsen_GB
dc.titleTheoretical investigation of the interaction of a polymer film with a nanoparticleen_GB
dc.typeDissertationde_DE
dc.identifier.urnurn:nbn:de:hebis:77-8564
dc.identifier.doihttp://doi.org/10.25358/openscience-1915-
jgu.type.dinitypedoctoralThesis
jgu.type.versionOriginal worken_GB
jgu.type.resourceText
jgu.organisation.departmentFB 08 Physik, Mathematik u. Informatik-
jgu.organisation.year2005
jgu.organisation.number7940-
jgu.organisation.nameJohannes Gutenberg-Universität Mainz-
jgu.rights.accessrightsopenAccess-
jgu.organisation.placeMainz-
jgu.subject.ddccode530
opus.date.accessioned2005-09-28T09:48:54Z
opus.date.modified2005-09-28T09:48:54Z
opus.date.available2005-09-28T11:48:54
opus.subject.otherStochastik, Brownsche Bewegung, Polymer Physik, Computational Physik, Hydrodynamikde_DE
opus.subject.otherStochastics, Brownian Motion, Polymer Physics, Computational Physics, Hydrodynamicsen_GB
opus.organisation.stringFB 08: Physik, Mathematik und Informatik: FB 08: Physik, Mathematik und Informatikde_DE
opus.identifier.opusid856
opus.institute.number0800
opus.metadataonlyfalse
opus.type.contenttypeDissertationde_DE
opus.type.contenttypeDissertationen_GB
jgu.organisation.rorhttps://ror.org/023b0x485
Appears in collections:JGU-Publikationen

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