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Tuning clathrate hydrates for hydrogen storage

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TLDR
Hydrogen storage capacities in THF-containing binary-clathrate hydrates can be increased to ∼4 wt% at modest pressures by tuning their composition to allow the hydrogen guests to enter both the larger and the smaller cages, while retaining low-pressure stability.
Abstract
The storage of large quantities of hydrogen at safe pressures is a key factor in establishing a hydrogen-based economy. Previous strategies--where hydrogen has been bound chemically, adsorbed in materials with permanent void space or stored in hybrid materials that combine these elements--have problems arising from either technical considerations or materials cost. A recently reported clathrate hydrate of hydrogen exhibiting two different-sized cages does seem to meet the necessary storage requirements; however, the extreme pressures (approximately 2 kbar) required to produce the material make it impractical. The synthesis pressure can be decreased by filling the larger cavity with tetrahydrofuran (THF) to stabilize the material, but the potential storage capacity of the material is compromised with this approach. Here we report that hydrogen storage capacities in THF-containing binary-clathrate hydrates can be increased to approximately 4 wt% at modest pressures by tuning their composition to allow the hydrogen guests to enter both the larger and the smaller cages, while retaining low-pressure stability. The tuning mechanism is quite general and convenient, using water-soluble hydrate promoters and various small gaseous guests.

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Journal ArticleDOI

Water dynamics on the hydrate lattice of a tetrabutyl ammonium bromide semiclathrate

TL;DR: Deuteron nuclear magnetic resonance (NMR) and dielectric spectroscopy are utilized to investigate the dynamics of the water molecules in the semiclathrate (tetra-n-butyl ammonium bromide) 26 H(2)O and reveal a nonexponential correlation function predominantly due to rotational motion with jump angles that are broadly distributed around the tetrahedral angle.
Journal ArticleDOI

Understanding the Phase Behavior of Tetrahydrofuran + Carbon Dioxide, + Methane, and + Water Binary Mixtures from the SAFT-VR Approach

TL;DR: Two sets of intermolecular potential model parameters are proposed to describe accurately either the hypercritical point associated with the closed-loop liquid-liquid immiscibility region or the location of the mixture lower- and upper-critical end-points.
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On interfacial properties of tetrahydrofuran: Atomistic and coarse-grained models from molecular dynamics simulation

TL;DR: The interfacial properties of tetrahydrofuran (THF) are determined from direct simulation of the vapor-liquid interface using six different molecular models, three of them based on the united-atom approach and the other three based on a coarse-grained (CG) approach.
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Self-Assembly, Chromic Properties, and Nanostructure Formation of Tetrathiafulvalene-Fused Dodecadehydro[18]annulenes

TL;DR: Multifunctional dodecadehydrotris(tetrathiafulvaleno)[18] and ANNULENES 1b-1d were synthesized together with the correspondin...
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Hydrogen storage as clathrate hydrates in the presence of 1,3-dioxolane as a dual-function promoter

TL;DR: In this article, the authors used 1,3-dioxolane (DIOX) as a dual-function thermodynamic and kinetic promoter for H2-contained (sII) hydrate formation, used at the stoichiometric concentration (5.56 mol%).
References
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Book

Infrared and Raman Spectra of Inorganic and Coordination Compounds

TL;DR: In this article, the normal modes of vibration are illustrated and corresponding vibrational frequencies are listed for each type, including diatomic, triatomic, fouratomic, five-atomic, six-atomic and seven-atomic types.
Journal ArticleDOI

Hydrogen-storage materials for mobile applications

TL;DR: Recent developments in the search for innovative materials with high hydrogen-storage capacity are presented.
Journal ArticleDOI

Hydrogen Storage in Microporous Metal-Organic Frameworks

TL;DR: Inelastic neutron scattering spectroscopy of the rotational transitions of the adsorbed hydrogen molecules indicates the presence of two well-defined binding sites (termed I and II), which are associated with hydrogen binding to zinc and the BDC linker, respectively.
Book

Comprehensive Supramolecular Chemistry

TL;DR: The aim of this book is to provide a history of Supramolecular Chemistry from its inception in the 1920s to the present day, with a focus on the period between 1950 and 1983.
Journal ArticleDOI

Hydrogen clusters in clathrate hydrate.

TL;DR: High-pressure Raman, infrared, x-ray, and neutron studies show that H2 and H2O mixtures crystallize into the sII clathrate structure with an approximate H2/H2Omolar ratio of 1:2.
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