Theoretical study of conformational disorder and selective adsorption of small organic molecules in the flexible metal-organic framework material MIL-53-Fe (2015)

First Author: Ling S

Attributed to: SI2-CHE: Collaborative Research: Developing First Principles Monte Carlo Methods for Reactive Phase and Sorption Equilibria in the CP2k Software Suite funded by EPSRC

No abstract provided

Type: Journal Article/Review

Parent Publication: Molecular Simulation

Issue: 16-17