Recent Advances in Carbon Capture with Metal-Organic Frameworks
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Using density functional theory with a van der Waals-corrected functional, we elucidate how CO 2 binds to a novel "BTT-type" metal-organic framework (MOF) featuring open metal centers. We show that CO 2 binds most favorably to open metal cation sites, but ...
Within the challenge of mitigating climate change, CO2 capture and storage (CCS) is considered as promising option to reduce the atmospheric CO2 emissions. In power plants three different concepts have emerged: post-combustion applying an end of pipe techn ...
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We use the multiscale simulation approach, which combines the first-principles calculations and grand canonical Monte Carlo simulations, to comprehensively study the doping of a series of alkali (Li, Na, and K), alkaline-earth (Be, Mg, and Ca), and transit ...
We report scanning tunneling microscopy observations on the formation of 2D Co-based coordination compounds on the reconstructed Au(111) surface. Preorganized arrays of Co bilayer islands are shown to be local reaction sites, which are consumed in the form ...
Within the goal of reducing the atmospheric CO2 emissions, CO2 capture and storage (CCS) is regarded as a promising option. For CO2 capture different concepts are investigated; post-combustion, pre-combustion and oxyfuel-combustion (pure O2 oxidation). Her ...
This paper presents the development of a platform for studying, designing and optimizing complex integrated energy systems. Technology models representing the physical behavior are separated from thermo-economic analysis and multi-objective optimization in ...
Actually the world is facing the dual challenge of energy supply security and mitigating climate change due to greenhouse gas emissions. In this context different alternatives to reduce the atmospheric CO2 emissions are increasing the efficiency, switching ...
The multicomponent reaction of diboronic acids with a catechol and a tripyridyl linker results in the formation trigonal prismatic cages. The cages feature six dative boron–nitrogen bonds as structure-directing elements. The size of the cages can be varied ...
Getting CO2under control: This Review highlights the challenges for carbon capture and storage technologies which have been proposed to reduce CO2 emissions from large point sources. The most recent developments in new materials and emerging concepts for C ...