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Total scattering of Zintl phase deuterides CaSiD1.3, BaSiD1.9 and SrGeD1.3
The Zintl phase hydrides CaSiH1.3, BaSiH1.9 and SrGeH1.3 exhibit hydride anions in alkaline earth metal voids as well as hydrogen bound to the polyanions formed by silicon /... -
A single-crystal sapphire cell for in situ powder diffraction on a TOF spectr...
Many technologically important processes from ore smelting to hydrogen storage and the synthesis of functional materials rely on solid-gas reactions. Following these reactions... -
Crossover between diffusive and ballistic transport regimes in the S=1/2 Heis...
The question of whether the spin transport in an S=1/2 Heisenberg antiferromagnetic chain is ballistic or diffusive remains intensely discussed theoretically and studied... -
Catalysis in Hydrogen-Bond Rich Porous Organic Materials
Hydrogen bonding (H-bonding) interactions are essential in biological and chemical processes, particularly in reactions catalysed by enzymes and small-molecule catalysts.... -
Programme Access Rosseinsky
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Effect of high temperatures on the adsorption of benzotriazole onto copper/co...
Benzotriazole (BTAH) is a very effective corrosion inhibitor for copper and its alloys in both water and in oils. BTAH is introduced as a corrosion inhibitor in oil based... -
Lattice dynamics in the giant barocaloric Ammonium Sulfate
Given the challenges in providing efficient and non-harmful refrigeration, it is timely to study barocaloric systems, which offer cooling power via the application of pressure,... -
Critical evidence for/against FLPs in metal oxides: Does H2 split on In2O3 Na...
The critical evidence for/against FLPs in metal oxides is to establish wheter an adsorbed H2 molecule becomes dissociated across adjacent In and O sites on the surface. To probe... -
In-situ neutron diffraction investigation of Ni-based batteries
Ni-based secondary batteries are currently used in many applications, however, the structural changes at the electrodes are not fully characterized and neutron diffraction is a... -
Pressure-induced proton migration in an energetic co-crystal
The results of these studies will provide valuable information on the effects of extreme conditions on the structures of an energetic salt and co-crystal formed between... -
In Situ High Pressure NMR study of the Direct Synthesis of NaAlH4
NaAlH4 has been a model system for metal hydride hydrogen storage materials since the reaction was identified to be reversible. The decomposition pathway has been described by a... -
Non-collinear Order and Spin Fluctuations in Chiral Cyanide-bridged Molecular...
A series of cyanide-bridged molecular magnets incorporating chiral ligands will be invstigated using muon spin relaxation. The magnets combine Ni(II) with M(III) (M=Fe,Cr,Co).... -
VT studies of the local structure of a fuel cell cathode and lead-free ferroe...
We are about to submit a detailed pair distribution function study of a new lead-free ferroelectric material based on RMC analysis. This method will be applied in VT studies of... -
Structure and Phase Transitions of XNbOP2O7, with X = ND4 and Rb
In this proposal we request 3 days of beam time on HRPD to study the structure and phase transitions of XNbOP2O7 (X = Rb and ND4). These materials have been shown to undergo... -
Materials Testing for gaskets and anvils
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The Location of Guests in Metal-Organic Frameworks Using IINS
Metal-organic framework materials are a topical family of nanoporous solids that have potential applications in molecular storage, separation and catalysis. This includes the... -
Transport properties of garnet-type Lithium lanthanum zirconium oxide solid-s...
To address the safety problems of lithium-ion batteries mainly caused by to flammable liquid electrolytes, all-solid-state-lithium-batteries (ASSLBs) with solid-state... -
Anisotropic Displacement Parameters and Diffuse Scattering in Graphite
The accurate description of van-der-Waals forces within DFT is currently one of the most active areas of research in computational physics and chemistry. In the case of soft... -
Structural distortions and partial order in the selenate and chromate analogu...
The mineral mirabilite (di-sodium sulfate decahydrate) has been extensively studied by X-ray and neutron powder and single-crystal diffraction methods. The structure contains an... -
Startup and Calibration
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