Multiscale Aspects of Modeling Gas-Phase Nanoparticle Synthesis
Identifieur interne : 000936 ( Main/Exploration ); précédent : 000935; suivant : 000937Multiscale Aspects of Modeling Gas-Phase Nanoparticle Synthesis
Auteurs : Beat Buesser [Suisse, États-Unis] ; Arto J. Gröhn [Suisse]Source :
- Chemical engineering & technology [ 0930-7516 ] ; 2012.
Descripteurs français
- Pascal (Inist)
- Wicri :
- topic : Aérosol.
English descriptors
- KwdEn :
Abstract
Aerosol reactors are utilized to manufacture nanoparticles in industrially relevant quantities. The development, understanding, and scale-up of aerosol reactors can be facilitated with models and computer simulations. An overview of recent developments of models and simulations is presented and their interconnection in a multiscale approach is discussed. A short introduction of the various aerosol reactor types and gas-phase particle dynamics is provided as a background for the later discussion of the models and simulations. Models are presented with de- creasing time and length scales in sections on continuum, mesoscale, molecular dynamics, and quantum mechanics models.
Affiliations:
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Le document en format XML
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<profileDesc><textClass><keywords scheme="KwdEn" xml:lang="en"><term>Aerosols</term>
<term>Computer simulation</term>
<term>Extrapolation</term>
<term>Modeling</term>
<term>Molecular dynamics method</term>
<term>Nanoparticle</term>
<term>Numerical simulation</term>
<term>Quantum mechanics</term>
<term>Reactor</term>
<term>Scale effect</term>
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<keywords scheme="Pascal" xml:lang="fr"><term>Modélisation</term>
<term>Nanoparticule</term>
<term>Aérosol</term>
<term>Réacteur</term>
<term>Extrapolation</term>
<term>Effet échelle</term>
<term>Simulation ordinateur</term>
<term>Simulation numérique</term>
<term>Méthode dynamique moléculaire</term>
<term>Mécanique quantique</term>
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<front><div type="abstract" xml:lang="en">Aerosol reactors are utilized to manufacture nanoparticles in industrially relevant quantities. The development, understanding, and scale-up of aerosol reactors can be facilitated with models and computer simulations. An overview of recent developments of models and simulations is presented and their interconnection in a multiscale approach is discussed. A short introduction of the various aerosol reactor types and gas-phase particle dynamics is provided as a background for the later discussion of the models and simulations. Models are presented with de- creasing time and length scales in sections on continuum, mesoscale, molecular dynamics, and quantum mechanics models.</div>
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