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Scrutinizing the role of the counterion in the axial coordination of the Pd(I...
The solution chemistry of Pt(II) and Pd(II) cations has attracted experimental and theoretical attention because of their relevance in catalytic processes and the... -
Hydrogenation of frustrated Lewis pairs in solution
It has been postulated that 'Frustrated Lewis Pairs' react after associating in an encounter complex held by dispersion forces, and that is it is this complex that interacts,... -
Molecular motions in novel water-soluble organometallic gels
The aim of this proposal is to study the internal dynamics of a novel organometallic polymers based on two metal-containing moieties -Ru, Au- bridged through a tridentate... -
Study of quadrupolar interactions in aromatic liquids: Benzene, hexafluoroben...
The non-covalent interactions between aromatic rings are of fundamental importance in large number biological and chemical processes. Examples include protein tertiary... -
The microscopic structure of the acetone - chloroform azeotrope
The acetone - chloroform system is the classic textbook example of a negative-pressure azeotrope, i.e. the vapour pressures of the binary mixtures are lower than expected for... -
When like-charged ions attract: Size and distribution of cationic clusters in...
Contrary to the strong electrostatic repulsion between like charged ions, last year the Ludwig group, used IR and NMR spectroscopy combined with computational methods, to reveal... -
Solvation structure of propane/propene in [C4mim][NTf2] ionic liquid
Supported ionic liquid membranes offer potentially lower-energy alternatives to cryogenic distillation for the separation and isolation of light gas olefins (ethene and propene)... -
High temperature superstructures in thermoelectric oxides
Sodium cobalate has emerged as one of the best thermoelectric materials. Our previous neutron Laue diffraction studies on SXD have found ordered arrays of multivacancy clusters,... -
Solvation structure of sodium ions and hexa-fluorophosphate ions in organic c...
Here we propose to study the local structure of sodium in standard organic carbonate electrolytes for sodium ion batteries. Three different electrolytes are chosen to study; a... -
Solvent-gelator interactions in supramolecular gels
An intriguing case of self assembly is the formation of supramolecular gels. Small organic "gelator" molecules in solution self assemble into a fibrous network which forms gels... -
Nanostructure of a New Class of Deep Eutectic Solvents Derived from Protic Io...
In earlier SANDALS investigations we have shown that protic ionic liquids (PILs) are nanostructured in the bulk, and how dissolved inorganic salts and small molecule solvents... -
Understanding Sulphur and Nitrogen-Aromatic interactions from liquid structure
Asphaltenes are a complex and problematic fraction of crude oil that can precipitate, alter wettability and stabilise unwanted oil-in-water emulsions. Asphaltenes have a high... -
A new plastic phase in PCBM from low-energy inlelastic neutron scattering
Phenyl-C61-butyric acid methyl ester (PCBM) is a fullerene-based material of high technological interest due to its use in organic solar photovoltaic cells. A better... -
Deep Eutectic Solvents: Metal Ion Dissolution
Deep Eutectic Solvents (DES) are molecular mixtures similar to ionic liquids, having melting points below room temperature. However instead of being composed of a salt, the... -
Local structure and clustering in acetic acid/pyridine mixtures
The aim of this proposed work is to complete our study of the behaviour of acetic acid/pyridine mixtures as a functionof composition, in order to fully characterise the changes... -
Hydration of NMA
We propose to study the hydration of N-methylacetamide (NMA) at ambient conditions and at two concentrations, namely 1 NMA : 50 H2O and 1 NMA : 15 H2O, by applying the isotopic... -
Solvation structures of cyclic compounds: the crown ethers
Crown ethers are cyclic molecules formed by joining ether groups into a ring. These compounds have many interesting solution properties, including their ability to bind strongly... -
Proton Zero Point Energy Effects on the Folding of Proteins
Earlier experiment at ISIS have shown that water responds to the distortion of the hydrogen bond network by delocalizing some of the protons in the vicinity of the defects. That... -
Copy of: Division of the supercritical fluid state into liquid- and gas-like ...
In recent years, the long-standing belief that beyond the critical point, matter exhibits no clear transition between liquid-like and gas-like states has been questioned. A line... -
Understanding Short Strong Hydrogen Bonds between Anions in Non-Aqueous Solve...
It is undeniable that hydrogen bonding plays a fundamental role in all biological systems. Not only is hydrogen bonding between water and bio-molecules important, but the more...
