KAUST’s MFDA model chooses from 10,000 solvents and boost organic thermoelectric output by 20×, making waste-heat harvesting practical.

Most of these packages are developed with a focus in the solute. The use of clustering for trajectories that include the solvent remains relatively unexplored. Considering solvent molecules is ...

Efficient Monte Carlo simulations are used to determine the liquid–liquid binodal line of mixtures of hard-sphere colloids and neutral polymers under good-solvent conditions for two values of the ...