@article{GhobadiHeuchelKratzetal.2013, author = {Ghobadi, Ehsan and Heuchel, Matthias and Kratz, Karl and Lendlein, Andreas}, title = {Simulating the shape-Memory behavior of amorphous switching domains of Poly(L-lactide) by molecular dynamics}, series = {Macromolecular chemistry and physics}, volume = {214}, journal = {Macromolecular chemistry and physics}, number = {11}, publisher = {Wiley-VCH}, address = {Weinheim}, issn = {1022-1352}, doi = {10.1002/macp.201200450}, pages = {1273 -- 1283}, year = {2013}, abstract = {The thermally induced shape-memory effect of polymers is typically characterized by cyclic uniaxial thermomechanical tests. Here, a molecular-dynamics (MD) simulation approach of such a cyclic uniaxial thermomechanical test is presented for amorphous switching domains of poly(L-lactide) (PLLA). Uniaxial deformation of the constructed PLLA models is simulated with a Parinello-Rahman scheme, as well as a pragmatic geometrical approach. We are able to describe two subsequent test cycles using the presented simulation approach. The obtained simulated shape-memory properties in both test cycles are similar and independent of the applied deformation protocols. The simulated PLLA shows high shape fixity ratios (Rf 94\%), but only a moderate shape recovery ratio is obtained (Rr 30\%). Finally, the structural changes during the simulated test are characterized by analysis of the changes in the dihedral angle distributions.}, language = {en} } @article{JulichGrunerLoewenbergNeffeetal.2013, author = {Julich-Gruner, Konstanze K. and L{\"o}wenberg, Candy and Neffe, Axel T. and Behl, Marc and Lendlein, Andreas}, title = {Recent trends in the chemistry of shape-memory polymers}, series = {Macromolecular chemistry and physics}, volume = {214}, journal = {Macromolecular chemistry and physics}, number = {5}, publisher = {Wiley-VCH}, address = {Weinheim}, issn = {1022-1352}, doi = {10.1002/macp.201200607}, pages = {527 -- 536}, year = {2013}, abstract = {Shape-memory polymers (SMPs) are stimuli-sensitive materials capable of performing complex movements on demand, which makes them interesting candidates for various applications, for example, in biomedicine or aerospace. This trend article highlights current approaches in the chemistry of SMPs, such as tailored segment chemistry to integrate additional functions and novel synthetic routes toward permanent and temporary netpoints. Multiphase polymer networks and multimaterial systems illustrate that SMPs can be constructed as a modular system of different building blocks and netpoints. Future developments are aiming at multifunctional and multistimuli-sensitive SMPs.}, language = {en} }