Theoretical Investigations of CO2 and H2 Sorption in Robust Molecular Porous Materials

Theoretical Investigations of CO2 and H2 Sorption in Robust Molecular Porous Materials

Molecular simulations of CO2 and H2 sorption were performed in MPM-1-Cl and MPM-1-TIFSIX, two robust molecular porous materials (MPMs) with the empirical formula [Cu2(adenine)4Cl2]Cl2 and [Cu2(adenine)4(TiF6)2], respectively. Recent experimental studies have shown that MPM-1-TIFSIX displayed higher...

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Veröffentlicht in:Langmuir : the ACS journal of surfaces and colloids. - 1992. - 32(2016), 44 vom: 08. Nov., Seite 11492-11505
1. Verfasser: Pham, Tony (VerfasserIn)
Weitere Verfasser: Forrest, Katherine A, Chen, Kai-Jie, Kumar, Amrit, Zaworotko, Michael J, Space, Brian
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2016
Zugriff auf das übergeordnete Werk:Langmuir : the ACS journal of surfaces and colloids
Schlagworte:Journal Article Research Support, U.S. Gov't, Non-P.H.S. Research Support, Non-U.S. Gov't