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Modelling of milk protein gels by brownian dynamics simulation of aggregated particle networks

机译:玉米蛋白凝胶模拟汇聚粒子网络模拟模拟

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We report on work based on the Brownian Dynamics simulation of interacting spherical colloidal particles leading to the formation of aggregated gel networks. The basic model incorporates the Brownian diffusion of soft spheres interacting via pair-wise surface-to-surface bonds and an optional long-range non-bonded interaction. Many-body hydrodynamics are neglected, apart from the drag effect. Surface bonds restrict angular reorganisation of aggregates during and after gelation, which allows the formation of a stable, percolating, three-dimensional network structure. We also describe the non-linear rheology of these systems in relation to their structure in response to constant strain-rate or constant stress (shear and elongational deformations). Allowing bond breakage enables the study of structural disruption in response to large deformations, and in this case the accompanying interparticle stress response reveals a distinctive stress overshoot characteristic of viscoelastic materials. The model has recently been extended to 16-segmented flexible casein xhains, which are formed by permanent bonds between nearest neighbours along the chain.
机译:我们基于棕色动力学模拟的互动球形胶体颗粒的工作报告,导致聚集凝胶网络的形成。基本模型包括通过配对表面到表面键合的软球的布朗扩散和可选的远程非粘合相互作用。除了拖动效果之外,许多身体流体动力学都被忽略了。表面键限制在凝胶化期间和之后的聚集体的角重组,这允许形成稳定,渗透的三维网络结构。我们还描述了与它们的结构相对于响应于恒定应变率或常量应力(剪切和伸长变形)而言的这些系统的非线性流变学。允许粘合断裂能够响应大变形而实现结构中断的研究,并且在这种情况下,伴随的颗粒应力响应揭示了粘弹性材料的独特应力过冲特性。该模型最近延伸到16分段的柔性酪蛋白Xhains,其由沿着链条的最近邻居之间的永久键形成。

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