Molecular Dynamics Studies of Liquid-vapor Interfacial Phenomena and Related Nanoscale Systems

Molecular Dynamics Studies of Liquid-vapor Interfacial Phenomena and Related Nanoscale Systems PDF Author: Aaron Paul Wemhoff
Publisher:
ISBN:
Category :
Languages : en
Pages : 380

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Molecular Dynamics Simulation of Liquid-vapor Interfacial Phenomena

Molecular Dynamics Simulation of Liquid-vapor Interfacial Phenomena PDF Author: Aaron Wemhoff
Publisher:
ISBN:
Category :
Languages : en
Pages : 122

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Fluid Interfacial Phenomena

Fluid Interfacial Phenomena PDF Author: Clive A. Croxton
Publisher:
ISBN:
Category : Science
Languages : en
Pages : 800

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Leading contributors describe state-of-the-art research in experimental and theoretical liquid interfacial phenomena. Areas covered include the intrinsic interface, dynamics at a liquid-vapour interface, structure and properties of the liquid-vapour interface of a simple metal, the electric double layer, light-scattering at the fluid interface, statistical mechanics of spherical surfaces, and properties of water layers adjacent to interfaces.

Computational Studies of Interfacial Phenomena Via Nanoscale Modeling of Functionalized Surfaces

Computational Studies of Interfacial Phenomena Via Nanoscale Modeling of Functionalized Surfaces PDF Author: Leebyn Thomas Chong
Publisher:
ISBN:
Category : Molecular dynamics
Languages : en
Pages : 113

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Interfacial phenomena and the associated kinetic, thermodynamic and structural properties are relevant in a variety of applications spanning energy, sustainability and medicine. Catalytic materials for alternate energy sources are critically dependent upon nanoscale surface morphologies to control reactant adsorption. Similarly, heavy metal removal by pH responsive branched polymers relies on the chelating properties of the adsorbant. Finally, asymmetric functionalization of nanoparticles can be used to create nanomaterials via self-assembly for use in multi-functional drug delivery platforms. Although experimental investigations have successfully characterized materials with functionalized surfaces, the interfacial phenomena are poorly understood at the molecular level. Thus, efforts in computational modeling are used to explain surface mechanisms. However, all-atom simulations are computationally expensive, and are limited to capturing short spatiotemporal scales. This dissertation proposes new multiscale modeling tools and methodologies for designing functionalized surfaces for controlling interfacial phenomenon. Through implicit solvent force fields and coarse-graining schemes, simulations using models of functionalized surfaces are able to resolve longer length and time scales. Investigations of interfacial phenomena include water adsorption on titanium dioxide, lead ion capture by anchored polyamidoamine dendrons, and aggregation of polymer-grafted cowpea mosaic virus capsids, via the use of the molecular dynamics simulation technique. The new models are validated by comparisons with experiments and other computational studies, and are used to provide fundamental insight via characterization of the system properties.

Interfacial Phenomena

Interfacial Phenomena PDF Author: Clarence A. Miller
Publisher: CRC Press
ISBN: 1420044435
Category : Science
Languages : en
Pages : 524

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Since the publication of the first edition of Interfacial Phenomena, the interest in interfaces and surfactants has multiplied, along with their applications. Experimental and theoretical advances have provided scientists with greater insight into the structure, properties, and behavior of surfactant and colloid systems. Emphasizing equil

Nanoscale Liquid-vapor Interfaces and Their Role in Microbubble Formation

Nanoscale Liquid-vapor Interfaces and Their Role in Microbubble Formation PDF Author: Jian-Gang Weng
Publisher:
ISBN:
Category :
Languages : en
Pages : 344

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Liquid-Vapor Phase-Change Phenomena

Liquid-Vapor Phase-Change Phenomena PDF Author: Van P. Carey
Publisher: CRC Press
ISBN: 1498716636
Category : Science
Languages : en
Pages : 731

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Book Description
Since the second edition of Liquid-Vapor Phase-Change Phenomena was written, research has substantially enhanced the understanding of the effects of nanostructured surfaces, effects of microchannel and nanochannel geometries, and effects of extreme wetting on liquid-vapor phase-change processes. To cover advances in these areas, the new third edition includes significant new coverage of microchannels and nanostructures, and numerous other updates. More worked examples and numerous new problems have been added, and a complete solution manual and electronic figures for classroom projection will be available for qualified adopting professors.

Molecular Dynamics Studies of Interfacial Properties of Complex Liquid Systems

Molecular Dynamics Studies of Interfacial Properties of Complex Liquid Systems PDF Author: Jian Ouyang
Publisher:
ISBN:
Category : Molecular dynamics
Languages : en
Pages : 444

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Dissertation Abstracts International

Dissertation Abstracts International PDF Author:
Publisher:
ISBN:
Category : Dissertations, Academic
Languages : en
Pages : 994

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Interfacial Nanochemistry

Interfacial Nanochemistry PDF Author: Hitoshi Watarai
Publisher: Springer Science & Business Media
ISBN: 038727541X
Category : Science
Languages : en
Pages : 328

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Book Description
The history of the liquid-liquid interface on the earth might be as old as that of the liquid. It is plausible that the generation of the primitive cell membrane is responsible for an accidental advent of the oldest liquid interfaces, since various compounds can be concentrated by an adsorption at the interface. The presence of liquid-liquid interface means that real liquids are far from ideal liquids that must be miscible with any kinds of liquids and have no interface. Thus it can be said that the non-ideality of liquids might generate the liquid-liquid interface indeed and that biological systems might be generated from the non-ideal interface. The liquid-liquid interface has been, therefore, studied as a model of biological membrane. From pairing two-phases of gas, liquid and solid, nine different pairs can be obtained, which include three homo-pairs of gas-gas, liquid-liquid and solid-solid pairs. The gas-gas interface, however, is practically no use under the ordinary conditions. Among the interfaces produced by the pairing, the liquid-liquid interface is most slippery and difficult to be studied experimentally in comparison with the gas-liquid and solid-liquid interfaces, as the liquid-liquid interface is flexible, thin and buried between bulk liquid phases. Therefore, in order to study the liquid-liquid interface, the invention of innovative measurement methods has a primary importance.