Accurate Force Fields for Atomistic Simulations of Oxides, Hydroxides, and Organic Hybrid Materials up to the Micrometer Scale.

Autor: Kanhaiya, Krishan, Nathanson, Michael, in 't Veld, Pieter J., Zhu, Cheng, Nikiforov, Ilia, Tadmor, Ellad B., Choi, Yeol Kyo, Im, Wonpil, Mishra, Ratan K., Heinz, Hendrik
Zdroj: Journal of Chemical Theory & Computation; 11/28/2023, Vol. 19 Issue 22, p8293-8322, 30p
Databáze: Supplemental Index