Final Report

Hupp, Joseph T.

Northwestern University (Evanston, Ill.)

关键词: 37 Inorganic, Organic, Physical And Analytical Chemistry;    36 Materials Science;    Porous Materials Chemical Separations;    Simulation;    Porosity;   

DOI  :  10.2172/941007
RP-ID  :  DOEER15244-1
RP-ID  :  FG02-01ER15244
RP-ID  :  941007

美国|英语

来源: UNT Digital Library

【 摘 要 】

The premise of this project was that coordination chemistry could be used to devise new kinds of microporous materials and that these materials could exhibit nanoscale porosity and selective chemical separation capabilities. Our initial materials focus was on aggregates of discrete hollow molecules, especially molecular squares. Subsequently our focus turned largely toward permanently microporous metal-organic frameworks (MOFs). Our approach emphasized coupling predictive & explanative computational modeling to materials design, synthesis, and property characterization.