Cover of ACS Central Science

The perspective of Daniele and Leopold on the cover of ACS Central Science.

D. Ongari, L. Talirz, and B. Smit, Too Many Materials and Too Many Applications: An Experimental Problem Waiting for a Computational Solution ACS Cent. Sci.  (2020)

Evaluating the properties and performances of nanoporous materials from their crystal structure is a long-standing puzzle for the scientific community. The effort of putting together the pieces of computational modeling aims to offer a clearer and more complete picture on how to identify the best materials for a given application.