Constrained Molecular Dynamics Simulations of Atomic Ground-States

Constrained molecular dynamics(CoMD) model, previously introduced for nuclear dynamics, has been extended to the atomic structure and collision calculations. Quantum effects corresponding to the Pauli and Heisenberg principle are enforced by constraints, in a parameter-free way. Our calculations for small atomic system, H, He, Li, Be, F reproduce the ground-state binding energies within 3%, compared with the results of quantum mechanical Hartree-Fock calculations.Comment: 3 pages, 2 figure

On inhibiting runaway in catalytic reactors

We consider the problem of heat and mass transfer in porous catalyst pellets. Both the steady and time dependent operating characteristics are studied. Accurate approximate equations are derived from the basic governing equations of motion. A nonlinear stability analysis is employed to account for the observation that under certain conditions reactions on catalyst pellets can pass transiently stably into a region which would correspond to instability in the steady state. One consequence of our analysis is a possible control mechanism which inhibits temperature runaway by extending the stable operating characteristics desirable in modern reactors

The impact of an emotionally expressive writing intervention on eating pathology in female students

© 2018 The Author(s). Published by Informa UK Limited, trading as Taylor & Francis Group.Introduction: Previous research demonstrating emotional influences on eating and weight suggest that emotionally expressive writing may have a significant impact on reducing risk of eating pathology. This study examined the effects of writing about Intensely Positive Experiences on weight and disordered eating during a naturalistic stressor. Method: Seventy-one female students completed an expressive or a control writing task before a period of exams. Both groups were compared on BMI (kg/m2) and the Eating Disorder Examination – Questionnaire (EDE-Q) before the writing task and at 8-week follow-up. A number of secondary analyses were also examined (to identify potential mediators) including measures of attachment, social rank, self-criticism and self-reassurance, stress and mood. Results: There was a significant effect of intervention on changes in the subscales of the EDE-Q (p = .03). Specifically, expressive writers significantly reduced their dietary restraint while those in the control group did not. There was no significant effect of the intervention on changes in BMI or the other subscales of the EDE-Q (Eating, Weight and Shape Concern). There was also no effect of writing on any of the potential mediators in the secondary analyses. Discussion: Emotionally expressive writing may reduce the risk of dietary restraint in women but these findings should be accepted with caution. It is a simple and light touch intervention that has the potential to be widely applied. However, it remains for future research to replicate these results and to identify the mechanisms of action.Peer reviewedFinal Published versio

Crustal deformation, the earthquake cycle, and models of viscoelastic flow in the asthenosphere

The crustal deformation patterns associated with the earthquake cycle can depend strongly on the rheological properties of subcrustal material. Substantial deviations from the simple patterns for a uniformly elastic earth are expected when viscoelastic flow of subcrustal material is considered. The detailed description of the deformation pattern and in particular the surface displacements, displacement rates, strains, and strain rates depend on the structure and geometry of the material near the seismogenic zone. The origin of some of these differences are resolved by analyzing several different linear viscoelastic models with a common finite element computational technique. The models involve strike-slip faulting and include a thin channel asthenosphere model, a model with a varying thickness lithosphere, and a model with a viscoelastic inclusion below the brittle slip plane. The calculations reveal that the surface deformation pattern is most sensitive to the rheology of the material that lies below the slip plane in a volume whose extent is a few times the fault depth. If this material is viscoelastic, the surface deformation pattern resembles that of an elastic layer lying over a viscoelastic half-space. When the thickness or breath of the viscoelastic material is less than a few times the fault depth, then the surface deformation pattern is altered and geodetic measurements are potentially useful for studying the details of subsurface geometry and structure. Distinguishing among the various models is best accomplished by making geodetic measurements not only near the fault but out to distances equal to several times the fault depth. This is where the model differences are greatest; these differences will be most readily detected shortly after an earthquake when viscoelastic effects are most pronounced

Information Flow in an R and D Laboratory

Statistical analysis of hypotheses concerning roles of technological gatekeeper and primary groups in flow of information in small research and development laborator

Gamma-ray bursts during neutron star formation. Gamma-ray bursts and transient X-ray sources

Discussions are presented of the associations between cosmic gamma ray bursts and transient X-ray sources, and the release of gravitational binding energy during the formation of neutron stars. The model for studying the associations is described along with the release of neutrinos during the collapse of white dwarfs

Asymptotic Methods for Metal Oxide Semiconductor Field Effect Transistor Modeling

The behavior of metal oxide semiconductor field effect transistors (MOSFETs) with small aspect ratio and large doping levels is analyzed using formal perturbation techniques. Specifically, the influence of interface layers in the potential on the averaged channel conductivity is closely examined. The interface and internal layers that occur in the potential are resolved in the limit of large doping using the method of matched asymptotic expansions. This approach, together with other asymptotic techniques, provides both a pointwise description of the state variables as well as lumped current-voltage relations that vary uniformly across the various bias regimes. These current-voltage relations are derived for a variable doping model respresenting a particular class of devices