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cond-mat.soft2012
A Simulation Study of the Lithium Ion Transport Mechanism in Ternary Polymer Electrolytes - The Critical Role of the Segmental Mobility
Diddo Diddens, Andreas Heuer
We present an extensive molecular dynamics (MD) simulation study of the lithium ion transport in ternary polymer electrolytes consisting of poly(ethylene oxide) (PEO), lithium-bis(…
cond-mat.soft2012
Chain End Mobilities in Polymer Melts - A Computational Study
Diddo Diddens, Andreas Heuer
The Rouse model can be regarded as the standard model to describe the dynamics of a short polymer chain under melt conditions. In this contribution, we explicitly check one of the…
cond-mat.soft2012
Lithium Ion Transport Mechanism in Ternary Polymer Electrolyte-Ionic Liquid Mixtures - A Molecular Dynamics Simulation Study
Diddo Diddens, Andreas Heuer
The lithium transport mechanism in ternary polymer electrolytes, consisting of PEO/LiTFSI and various fractions of the ionic liquid N-methyl-N-propylpyrrolidinium bis(trifluorometh…