105 research outputs found
Deconstructing classical water models at interfaces and in bulk
Using concepts from perturbation and local molecular field theories of
liquids we divide the potential of the SPC/E water model into short and long
ranged parts. The short ranged parts define a minimal reference network model
that captures very well the structure of the local hydrogen bond network in
bulk water while ignoring effects of the remaining long ranged interactions.
This deconstruction can provide insight into the different roles that the local
hydrogen bond network, dispersion forces, and long ranged dipolar interactions
play in determining a variety of properties of SPC/E and related classical
models of water. Here we focus on the anomalous behavior of the internal
pressure and the temperature dependence of the density of bulk water. We
further utilize these short ranged models along with local molecular field
theory to quantify the influence of these interactions on the structure of
hydrophobic interfaces and the crossover from small to large scale hydration
behavior. The implications of our findings for theories of hydrophobicity and
possible refinements of classical water models are also discussed
Understanding preventive behaviors among mid-Western African-American men: a pilot qualitative study of prostate screening
http://dx.doi.org/10.1016/j.jomh.2011.03.00
On the origin and evolution of the material in 67P/Churyumov-Gerasimenko
International audiencePrimitive objects like comets hold important information on the material that formed our solar system. Several comets have been visited by spacecraft and many more have been observed through Earth- and space-based telescopes. Still our understanding remains limited. Molecular abundances in comets have been shown to be similar to interstellar ices and thus indicate that common processes and conditions were involved in their formation. The samples returned by the Stardust mission to comet Wild 2 showed that the bulk refractory material was processed by high temperatures in the vicinity of the early sun. The recent Rosetta mission acquired a wealth of new data on the composition of comet 67P/Churyumov-Gerasimenko (hereafter 67P/C-G) and complemented earlier observations of other comets. The isotopic, elemental, and molecular abundances of the volatile, semi-volatile, and refractory phases brought many new insights into the origin and processing of the incorporated material. The emerging picture after Rosetta is that at least part of the volatile material was formed before the solar system and that cometary nuclei agglomerated over a wide range of heliocentric distances, different from where they are found today. Deviations from bulk solar system abundances indicate that the material was not fully homogenized at the location of comet formation, despite the radial mixing implied by the Stardust results. Post-formation evolution of the material might play an important role, which further complicates the picture. This paper discusses these major findings of the Rosetta mission with respect to the origin of the material and puts them in the context of what we know from other comets and solar system objects
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