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NEUTRON DIFFRACTION AND EPSR SIMULATIONS OF THE HYDRATION STRUCTURE AROUND PROPANE MOLECULES BEFORE AND DURING GAS HYDRATE FORMATION
2008
Fundamental understanding of the structural changes occurring during hydrate formation and inhibition is important in the development of new strategies to control hydrates in flowlines and in inhibitor design. Neutron diffraction coupled with Empirical Potential Structure Refinement (EPSR) simulation has been used to determine the hydration structure around propane molecules before and during sII hydrate formation. The EPSR simulation results were generated by fitting neutron data (with H/D
doi:10.14288/1.0041028
fatcat:4skzeas3g5hfrocs5ur6dvrnyq