Modelling adsorption of a water molecule into various pore structures of silica gel

DOI10.1007/S10910-011-9887-3MaRDI QIDQ656983zbMATH OpenOpenAlexFDO

Authors D. Baowan, Ngamta Thamwattana

Publication date 13 January 2012

Published in Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1007/s10910-011-9887-3

zbMATH Keywords

Lennard-Jones potentialnanoporessilica geladsorption energywater adsorbents

Mathematics Subject Classification ID

Jets and cavities, cavitation, free-streamline theory, water-entry problems, airfoil and hydrofoil theory, sloshing (76B10) Classical flows, reactions, etc. in chemistry (92E20)

Recommendations

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• Diffusivity of CH₄In Model Silica Nanopores: Molecular Dynamics and Quasichemical Mean Field Theory
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Cites work

• scientific article; zbMATH DE number 1528193 (Why is no real title available?)
• scientific article; zbMATH DE number 3091796 (Why is no real title available?)
• Equilibrium locations for nested carbon nanocones
• Mechanics of atoms and fullerenes in single-walled carbon nanotubes. I. Acceptance and suction energies
• Mechanics of atoms and fullerenes in single-walled carbon nanotubes. II. Oscillatory behaviour

Cited in

(3)

• Stress-dependent molecular pathways of silica-water reaction
• A predictive multiphase model of silica aerogels for building envelope insulations
• Development of EEM based silicon-water and silica-water wall potentials for non-reactive molecular dynamics simulations

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