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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 102, 2004 - Issue 4
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Original Articles

Simulation of small molecule diffusion using continuous space disordered networks

Michael L. Greenfield Department of Chemical Engineering, University of Rhode Island, Kingston, RI 02881, USA
Pages 421-430 | Received 12 Aug 2003, Accepted 28 Feb 2004, Published online: 19 Aug 2006

Citations (9)

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Read on this site (1)

Liqun Zhang, Daniel J. Lacks & James A. Van Orman. (2009) Diffusivity calculation on noble gas silica systems using first-principles molecular simulations. Molecular Simulation 35:10-11, pages 942-952.
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Articles from other publishers (8)

Lili Ma, Hirad S. Salehi, Ruxin Jing, Sandra Erkens, Thijs J.H. Vlugt, Othonas A. Moultos, Michael L. Greenfield & Aikaterini Varveri. (2023) Water diffusion mechanisms in bitumen studied through molecular dynamics simulations. Construction and Building Materials 409, pages 133828.
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Claire A. Lemarchand, Michael L. Greenfield & Jesper S. Hansen. (2016) Dynamics and Structure of Bitumen–Water Mixtures. The Journal of Physical Chemistry B 120:24, pages 5470-5480.
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Panagiotis G. Mermigkis, Dimitrios G. Tsalikis & Vlasis G. Mavrantzas. (2015) Determination of the effective diffusivity of water in a poly (methyl methacrylate) membrane containing carbon nanotubes using kinetic Monte Carlo simulations. The Journal of Chemical Physics 143:16.
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Li Xi, Manas Shah & Bernhardt L. Trout. (2013) Hopping of Water in a Glassy Polymer Studied via Transition Path Sampling and Likelihood Maximization. The Journal of Physical Chemistry B 117:13, pages 3634-3647.
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Angelo Lucia. (2010) Multi-scale methods and complex processes: A survey and look ahead. Computers & Chemical Engineering 34:9, pages 1467-1475.
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Angelo Lucia. 2009. Design for Energy and the Environment. Design for Energy and the Environment 919 936 .
Frank T. Willmore, Xiao-Yan Wang & Isaac C. Sanchez. (2007) Gas diffusion in glasses via a probabilistic molecular dynamics . The Journal of Chemical Physics 126:23, pages 234502.
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O. Vitrac & M. Hayert. (2007) Effect of the distribution of sorption sites on transport diffusivities: A contribution to the transport of medium-weight-molecules in polymeric materials. Chemical Engineering Science 62:9, pages 2503-2521.
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