5 papers
Overscreening and Underscreening in Solid-Electrolyte Grain Boundary Space-Charge Layers
Jacob M. Dean, Samuel W. Coles, William R. Saunders +4
Polycrystalline solids can exhibit material properties that differ significantly from those of equivalent single-crystal samples, in part, because of a spontaneous redistribution o…
Neutron reflectometry analysis: using model-dependent methods
Andrew R. McCluskey
Neutron reflectometry analysis is an inherently ill-posed, which is to say that there are many possible solutions which agree equally well with the measured data. This leads to the…
An introduction to classical molecular dynamics simulation for experimental scattering users
Andrew R. McCluskey, James Grant, Adam R. Symington +5
Classical molecular dynamics simulations are a common component of multi-modal analyses from scattering measurements, such as small-angle scattering and diffraction. Users of these…
Assessing molecular simulation for the analysis of lipid monolayer reflectometry
Andrew R. McCluskey, James Grant, Andrew J. Smith +5
Using molecular simulation to aid in the analysis of neutron reflectometry measurements is commonplace. However, reflectometry is a tool to probe large-scale structures, and theref…
Bayesian determination of the effect of a deep eutectic solvent on the structure of lipid monolayers
Andrew R. McCluskey, Adrian Sanchez-Fernandez, Karen J. Edler +4
In this work, we present the first example of the self-assembly of phospholipid monolayers at the interface between air and an ionic solvent. Deep eutectic solvents are a novel cla…