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Liquid complex hydrides are a new class of hydrogen storage materials with several advantages over solid hydrides, e.g. they are flexible in shape, they are a flowing fluid and their convective properties facilitate heat transport. The physical and chemica ...
The research on complex hydrides for hydrogen storage was initiated by the discovery of Ti as a hydrogen sorption catalyst in NaAlH4 by Boris Bogdanovic in 1996. A large number of new complex hydride materials in various forms and combinations have been sy ...
Calcium silicate hydrate (C-S-H) was synthetized at 20 degrees C to investigate the effect of aluminium uptake (Al/Si = 0-0.33) in the presence and absence of alkalis on the composition and the solubility of a C-S-H with a Ca/Si equal to 1.0. C-S-H incorpo ...
Aqueous solutions of cesium formate and bicarbonate repre- sent an effective hydrogen storage–delivery couple that under- goes either release or take up of hydrogen in the presence of {RuCl2(mTPPTS)2}2 (TPPTS = triphenylphosphine trisulfonate) and excess m ...
Density functional theory calculations have been performed to provide details of the structural and charge-transfer details related to the solid solution of hydrogen in (delta)-plutonium. We follow the Flanagan model that outlines the process by which hydr ...
In the framework of the European Cooperation in Science and Technology (COST) Action MP1103 Nanostructured Materials for Solid-State Hydrogen Storage were synthesized, characterized and modeled. This Action dealt with the state of the art of energy storage ...
The decomposition pathway of the complex hydride Al3Li 4(BH4)13 is in the focus of this study. Initially the compound attracted great interest due to its high H2 capacity (17.2 wt.%) and desorption at moderate temperatures (<100 °C). This work sheds lig ...
Iron-catalyzed hydrogenation has drawn much attention, yet the scope and chemoselectivity of iron catalysis warrant further improvement. Here we report new iron pincer complexes as chemoselective hydrogenation and transfer hydrogenation catalysts. Several ...
The lactone motif is ubiquitous in natural products and pharmaceuticals. The Tishchenko disproportionation of two aldehydes, a carbonyl hydroacylation, is an efficient and atom-economic access to lactones. However, these reaction types are limited to the t ...
The nucleation mechanisms of methane hydrates are studied using well-tempered metadynamics and restrained molecular dynamics. The collective variables we used to follow the process are the methane-methane and methane-water coordination numbers, from which ...