List

Atomic configurations of glassy silica (SiO2) and Jade Glass generated by molecular dynamics (MD) and force-enhanced atomic refinement (FEAR). The configurations have the LAMMPS Data format. Computed neutron structure factors and ring size distribution (using the Guttman definition) are also provided.

Access to the data: SilicaJade

  Posts

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February 23rd, 2013

Transport Anomalies and Adaptative Pressure-Dependent Topological Constraints in Tetrahedral Liquids: Evidence for a Reversibility Window Analogue

Bauchy, M. and M. Micoulaut. 2013. "Transport anomalies and adaptative pressure-dependent topological constraints in tetrahedral liquids: evidence for a reversibility [...]
September 23rd, 2012

Viscosity and viscosity anomalies of model silicates and magmas: A numerical investigation

Bauchy, M., B. Guillot, M. Micoulaut, and N. Sator. 2013. "Viscosity and viscosity anomalies of model silicates and magmas: a [...]
May 23rd, 2012

Topological constraints and rigidity of network glasses from molecular dynamics simulations

Bauchy, Mathieu. 2012. "Topological constraints and rigidity of network glasses from molecular dynamics simulations." American Ceramic Society Bulletin, 91 (4): [...]
April 21st, 2012

Structural, vibrational, and thermal properties of densified silicates: Insights from molecular dynamics

Bauchy, M.. 2012. "Structural, vibrational, and thermal properties of densified silicates: Insights from molecular dynamics." Journal of Chemical Physics, 137 [...]
August 23rd, 2011

Angular rigidity in tetrahedral network glasses with changing composition

Bauchy, M., M. Micoulaut, M. Celino, S. Le Roux, M. Boero, and C. Massobrio. 2011. "Angular rigidity in tetrahedral network [...]
July 23rd, 2011

Atomic scale foundation of temperature-dependent bonding constraints in network glasses and liquids

Bauchy, M. and M. Micoulaut. 2011. "Atomic scale foundation of temperature-dependent bonding constraints in network glasses and liquids." Journal of [...]
May 23rd, 2011

From pockets to channels: Density-controlled diffusion in sodium silicates

Bauchy, M. and M. Micoulaut. 2011. "From pockets to channels: Density-controlled diffusion in sodium silicates." Physical Review B, 83 (18): [...]
March 23rd, 2010

Dynamics of slab tear faults: Insights from numerical modelling

Hale, Alina, Klaus-D Gottschaldt, Gideon Rosenbaum, Laurent Bourgouin, Matthieu Bauchy, and Hans M?hlhaus. 2010. "Dynamics of slab tear faults: Insights [...]
June 4th, 2007

Étude et contrôle du chaos dans un système mécanique

Rapport suite à un projet expérimental d’une semaine sur le sujet suivant : Etude et contrôle du chaos dans un […]