Search results for "Gas separation"
showing 4 items of 24 documents
Adsorptive Separation of CO2 by a Hydrophobic Carborane-Based Metal-Organic Framework under Humid Conditions
2023
We report that the carborane-based metal-organic framework (MOF) mCB-MOF-1 can achieve high adsorptive selectivity for CO2:N2 mixtures. This hydrophobic MOF presenting open metal sites shows high CO2 adsorption capacity and remarkable selectivity values that are maintained even under extremely humid conditions. The comparison of mCB-MOF-1' with MOF-74(Ni) demonstrates the superior performance of the former under challenging moisture operation conditions.
Exploration of the Solid-State Sorption Properties of Shape-Persistent Macrocyclic Nanocarbons as Bulk Materials and Small Aggregates.
2020
Porous molecular materials combine benefits such as convenient processability and the possibility for atom-precise structural fine-tuning which makes them remarkable candidates for specialty applications in the areas of gas separation, catalysis, and sensing. In order to realize the full potential of these materials and guide future molecular design, knowledge of the transition from molecular properties into materials behavior is essential. In this work, the class of compounds termed cycloparaphenylenes (CPPs)-shape-persistent macrocycles with built-in cavities and radially oriented π-systems-was selected as a conceptually simple class of intrinsically porous nanocarbons to serve as a platf…
Chemical design of coordination polymers and functional materials: from pore control in MOFs through spin dynamics in nanomagnets to rotaxanes in mol…
2022
El trabajo de esta tesis se enmarca en el diseño químico de polímeros de coordinación y de materiales funcionales para poder ser utilizados en el campo de los materiales moleculares. El capítulo 1 ofrece una visión de los avances más significativos en la química de coordinación, así como una introducción general de los materiales moleculares más relevantes en la actualidad. El objetivo es proporcionar al lector el conocimiento necesario para establecer las bases sobre los campos a tratar. El resto de capítulos está organizado de acuerdo con un aumento de la dimensionalidad, empezando con moléculas discretas y terminando con polímeros de coordinación. El capítulo dos describe dos estructuras…
Selective CO 2 Sorption Using Compartmentalized Coordination Polymers with Discrete Voids**
2021
Carbon capture and storage with porous materials is one of the most promising technologies to minimize CO2 release into the atmosphere. Here, we report a family of compartmentalized coordination polymers (CCPs) capable of capturing gas molecules in a selective manner based on two novel tetrazole-based ligands. Crystal structures have been modelled theoretically under the Density Functional Theory (DFT) revealing the presence of discrete voids of 380 A3 . Single gas adsorption isotherms of N2 , CH4 and CO2 have been measured, obtaining a loading capacity of 0.6, 1.7 and 2.2 molecules/void at 10 bar and at 298 K for the best performing material. Moreover, they present excellent selectivity an…