Numerical methods for unraveling inter-particle potentials in colloidal suspensions: A comparative study for two-dimensional suspensions
(2025)
Journal Article
Rees-Zimmerman, C. R., Martín-Roca, J., Evans, D., Miller, M. A., Aarts, D. G. A. L., & Valeriani, C. (2025). Numerical methods for unraveling inter-particle potentials in colloidal suspensions: A comparative study for two-dimensional suspensions. The Journal of Chemical Physics, 162(7), Article 074103. https://doi.org/10.1063/5.0246890
We compare three model-free numerical methods for inverting structural data to obtain interaction potentials, namely, iterative Boltzmann inversion (IBI), test-particle insertion (TPI), and a machine-learning (ML) approach called ActiveNet. Three arc... Read More about Numerical methods for unraveling inter-particle potentials in colloidal suspensions: A comparative study for two-dimensional suspensions.