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molecular dynamics simulations with LAMMPS, and data curation. Scientific context: Our current understanding of polymer viscoelasticity is founded on single-chain models [2]. Such models draw on the fact
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the physicochemical properties of alternative blowing agents and the final foam performance. They will also test the new formulations under conditions that simulate industrial processes (casting, spraying, high
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models that account for the dynamics of the actin polymer population in the cell cortex. The analysis will be carried out using probability theory and simulation tools, and will be based on a real effort
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contract is part of a collaborative project aiming at the fabrication of dense clusters of plasmonic nanoparticles and polymer with non-linear optical properties. The objective is to demonstrate
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‑chemical calculations on organic small molecules and π‑conjugated systems. • Conduct periodic DFT simulations to explore electronic band structures and transport. • Analyse charge transport, thermoelectric