3 papers
cond-mat.soft2025
Influence of Dispersity on the Relaxation of Entangled Polymers from Molecular Dynamics Simulations
Taofeek Tejuosho, Janani Sampath
Nonequilibrium molecular dynamics simulations are used to study the deformation behavior of disperse polymer melts by tracking test chains of length N = Mw, the weight average mole…
physics.chem-ph2024
Effect of Dispersity on Dynamic Properties of Polymer Melts: Insights from Coarse-Grained Molecular Dynamics Simulations
Taofeek Tejuosho, Sohil Kollipara, Sumant Patankar +1
Synthetic polymers have a distribution of chain lengths which can be characterized by dispersity, D. Macroscopic properties of polymers are influenced by chain mobility in the melt…
cond-mat.soft2024
Hydroxide Transport and Mechanical Properties of Polyolefin-Based Anion Exchange Membranes from Atomistic Molecular Dynamics Simulations
Mohammed Al Otmi, Ping Lin, William Schertzer +3
Anion exchange membranes are used in alkaline fuel cells and offer a promising alternative to the more expensive proton exchange membrane fuel cells. However, hydroxide ion conduct…