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Revising the onset of anharmonicity in proteins
Our previous INS studies of ¿dry¿/hydrated apoferritin show that the hydrated protein undergoes a dynamical transition, Td, at 200K. Such behavior, first modeled by Doster et al... -
QENS Studies of Diffusion of NH3 Molecules in Porous MOF Materials
The development of new porous metal-organic frameworks (MOFs) is receiving considerable attention worldwide owing to their potential for gas storage, separation, and... -
The Effect of Framework Structure and Composition on Controlled Drug Release ...
The mobility of beta-blocker and angina/hypertension drug atenolol in zeolites FAU and BEA will be probed using QENS to understand the importance of fundamental... -
Understanding Structure-Direction of Organic Molecules in Zeolite Synthesis t...
The mobility of zeolite structure directing agent (SDA) 1,2,3-triethylimidazolium (TEI) when still confined in zeolites MFI and STF after synthesis will be measured using... -
Proton diffusion in lithium imide: a quasi-elastic neutron scattering study
Li_2NH has been recently considered for H_2 storage applications. However, its low-T crystal structure is still controversial, with at least 6 options compatible with the... -
Investigating the diffusion of E-caprolactam in hierarchically-porous catalys...
Caprolactam (CL) is a high-value chemical and precursor to nylon-6. Industrially, a harsh, liquid-acid catalyst effects the Beckmann rearrangement of C6-oxime to CL, but the... -
Total scattering study of the II to I phase transition in pyridine
Atomistic characterisation of phase transitions in organic materials is important because of the role played by polymorphism in pharmaceuticals and agochemicals. Conventional... -
Dynamics of Confined CO2
This proposal aims to investigate and compare the dynamics of CO2 when confined in a nanoporous Vycor (SiO2) matrix. The field of fluids in confined geometries is currently of... -
Cs mixed cation lead perovskites
Organic-inorganic hybrid halide perovskites combine the optoelectronic properties commonly associated with high performance semiconductors with materials synthesis or processing... -
Investigating the diffusion of cyclic oximes in hierarchically-porous catalys...
Caprolactam (CL) is a high-value chemical precursor to nylon-6. On an industrial scale an aggressive liquid-acid catalyst is used to transform C6-oxime to CL. Due to... -
Me-ND311BD4: a temperature dependent study of its crystal structure and decom...
We request 4 days on HRPD with the IGAn apparatus to follow the structural changes of Me-ND4 11BD4 as a function of temperature. The high resolution of HRPD will allow us to... -
Understanding Structure-Direction of Organic Molecules in Zeolite Synthesis t...
The mobility of zeolite structure directing agent (SDA) 1,2,3-triethylimidazolium (TEI) when still confined in zeolites MFI and STF after synthesis will be measured using... -
CO2 adsorption selectivity in microporous MOF's based on Cu2 paddle-wheels
Metal-organic framework (MOF) materials are a kind of inorganic-organic hybrid materials with a open modular molecular architecture. Such a modularity opens a plethora of...