Evolutionary multi-objective optimization and Pareto-frontal uncertainty quantification of interatomic forcefields for thermal conductivity simulations

Autor: Krishnamoorthy, Aravind ⁎, 1, Mishra, Ankit 1, Grabar, Nicholas 1, Baradwaj, Nitish, K. Kalia, Rajiv, Nakano, Aiichiro, Vashishta, Priya
Zdroj: In Computer Physics Communications September 2020 254
Databáze: ScienceDirect