Fig. 3: MD simulations with a mixture of four kinds of monomers (EA, BA, DMAA, and TAcγCDAAmMe). | NPG Asia Materials

Fig. 3: MD simulations with a mixture of four kinds of monomers (EA, BA, DMAA, and TAcγCDAAmMe).

From: Preparation of dual-cross network polymers by the knitting method and evaluation of their mechanical properties

Fig. 3

Investigation of a suitable monomer ratio to penetrate into the cavity of TAcγCDAAmMe. a Snapshots of an isolated monomer of TAcγCDAAmMe and the system image in the monomer solution. b, c Snapshots of MD simulations in monomer solutions of (b) [EA]/[BA]/[TAcγCDAAmMe] = 400/400/8 and c [EA]/[BA]/[DMAA]/[TAcγCDAAmMe] = 200/200/400/8 (right). d The calculated number of monomers included in the TAcγCDAAmMe cavity with various composites ([EA]/[BA]/[DMAA] = 200x/200/400(1-x)). e The three-component diagram estimated from the calculated number of monomers included in the TAcγCDAAmMe cavity.

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