Search Results - "Bandera, Sara"

Effects of the Absence of Friction in Coarse-Grained Molecular Dynamics Simulations of Clay by Bandera, Sara, Morimoto, Tokio, O’Sullivan, Catherine, Tangney, Paul, Angioletti-Uberti, Stefano

“…Abstract Coarse-grained molecular dynamics (CGMD) simulations can advance the understanding of clay behavior. In CGMD simulations, the interactions between…”
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Isotropic compression simulation of kaolinite using coarse-grained molecular dynamics by Nakamichi, Yohei, O’Sullivan, Catherine, Angioletti-Uberti, Stefano, Tangney, Paul, Bandera, Sara

“…It is now viable to use coarse-grained molecular dynamics (CGMD) to model interacting clay particles in simulations of soil mechanics element tests. In CGMD,…”
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An evaluation of contact models for particle-scale simulation of clay by Bandera, Sara, O'Sullivan, Catherine, Angioletti-Uberti, Stefano, Tangney, Paul

“…Geotechnical engineers are well aware that the particle surface chemistry and the pore fluid composition can significantly influence the mechanical behaviour…”
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Coarse-grained molecular dynamics simulations of clay compression by Bandera, Sara, O'Sullivan, Catherine, Tangney, Paul, Angioletti-Uberti, Stefano

“…This paper outlines a framework for using molecular dynamics to simulate the compression of kaolinite saturated at alkaline pH (=8) in a low (1 mM)…”
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Response to the discussion on “Coarse-grained molecular dynamics of clay compression” by Bandera, Sara, O'Sullivan, Catherine, Tangney, Paul, Angioletti-Uberti, Stefano

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