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Comparison of aggregation behaviors between branched and linear block poly ethers: MesoDyn simulation study

机译:支链和线性嵌段聚醚之间聚集行为的比较:MesoDyn模拟研究

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The comparison of aggregation behaviors between the branched block polyether T1107 (polyether A) and linear polyether (EO)_(60)(PO)_(40)(EO)_(60) (polyether B) in aqueous solution are investigated by the MesoDyn simulation. Polyether A forms micelles at lower concentration and has a smaller aggregation number than B. Both the polyethers show the time-dependent micellar growth behaviors. The spherical micelles appear and then change to rod-like micelles with time evolution in the 10 vol% solution of polyether A. The micellar cluster appears and changes to pseudo-spherical micelles with time evolution in the 20 vol% solution of polyether A. However, the spherical micelles appear and change to micellar cluster with time evolution in the 20 vol% polyether B solution. The shear can induce the micellar transition of both block polyethers. When the shear rate is 1×10~5 s~(-1), the shear can induce the sphere-to-rod transition of both polyethers at the concentration of 10 and 20 vol%. When the shear rate is lower than 1×10~5 s~(-1), the huge micelles and micellar clusters can be formed in the 10 and 20 vol% polyether A systems under the shear, while the huge micelles are formed and then disaggregated with the time evolution in the 20 vol% polyether B system.
机译:支链聚醚T1107(聚醚A)和线性聚醚(EO)_(60)(PO)_(40)(EO)_(60)(聚醚B)在水溶液中的聚集行为比较通过MesoDyn模拟。聚醚A形成的胶束浓度比B低,且聚集数比B少。两种聚醚均表现出随时间变化的胶束生长行为。球形胶束在聚醚A的10体积%溶液中随时间变化出现,然后变为棒状胶束。随着聚醚A在20体积%的溶液中随时间变化,胶束团出现并变为伪球形胶束。 ,在20%(体积)的聚醚B溶液中,随着时间的发展,球形胶束出现并变成胶束簇。剪切可诱导两个嵌段聚醚的胶束转变。当剪切速率为1×10〜5 s〜(-1)时,剪切可以诱导两种聚醚在10%和20%(体积)浓度下的球-杆过渡。当剪切速率低于1×10〜5 s〜(-1)时,剪切作用下,在10%和20%(体积)聚醚A体系中可形成巨大的胶束和胶束簇,然后形成巨大的胶束。在20%(体积)的聚醚B体系中,随着时间的变化分解。

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