Multi-shell gold nanowires under compression

Deformation properties of multi-wall gold nanowires under compressive loading are studied. Nanowires are simulated using a realistic many-body potential. Simulations start from cylindrical fcc(111) structures at T=0 K. After annealing cycles axial compression is applied on multi-shell nanowires for a number of radii and lengths at T=300 K. Several types of deformation are found, such as large buckling distortions and progressive crushing. Compressed nanowires are found to recover their initial lengths and radii even after severe structural deformations. However, in contrast to carbon nanotubes irreversible local atomic rearrangements occur even under small compressions.Comment: 1 gif figure, 5 ps figure

Atomistic modelling of large-scale metal film growth fronts

We present simulations of metallization morphologies under ionized sputter deposition conditions, obtained by a new theoretical approach. By means of molecular dynamics simulations using a carefully designed interaction potential, we analyze the surface adsorption, reflection, and etching reactions taking place during Al physical vapor deposition, and calculate their relative probability. These probabilities are then employed in a feature-scale cellular-automaton simulator, which produces calculated film morphologies in excellent agreement with scanning-electron-microscopy data on ionized sputter deposition.Comment: RevTeX 4 pages, 2 figure

Angular Forces Around Transition Metals in Biomolecules

Quantum-mechanical analysis based on an exact sum rule is used to extract an semiclassical angle-dependent energy function for transition metal ions in biomolecules. The angular dependence is simple but different from existing classical potentials. Comparison of predicted energies with a computer-generated database shows that the semiclassical energy function is remarkably accurate, and that its angular dependence is optimal.Comment: Tex file plus 4 postscript figure

Mapping the Distribution of Electron Temperature and Fe Charge States in the Corona with Total Solar Eclipse Observations

The inference of electron temperature from the ratio of the intensities of emission lines in the solar corona is valid only when the plasma is collisional. Once collisionless, thermodynamic ionization equilibrium no longer holds, and the inference of an electron temperature and its gradient from such measurements is no longer valid. At the heliocentric distance where the transition from a collision-dominated to a collisionless plasma occurs, the charge states of different elements are established, or frozen-in. These are the charge states which are subsequently measured in interplanetary space. We show in this study how the 2006 March 29 and 2008 August 1 eclipse observations of a number of Fe emission lines yield an empirical value for a distance, which we call Rt , where the emission changes from being collisionally to radiatively dominated. Rt ranges from 1.1 to 2.0 R ☉, depending on the charge state and the underlying coronal density structures. Beyond that distance, the intensity of the emission reflects the distribution of the corresponding Fe ion charge states. These observations thus yield the two-dimensional distribution of electron temperature and charge state measurements in the corona for the first time. The presence of the Fe X 637.4 nm and Fe XI 789.2 nm emission in open magnetic field regions below Rt , such as in coronal holes and the boundaries of streamers, and the absence of Fe XIII 1074.7 nm and Fe XIV 530.3 nm emission there indicate that the sources of the solar wind lie in regions where the electron temperature is less than 1.2 × 106 K. Beyond Rt , the extent of the Fe X [Fe9+] and Fe XI emission [Fe10+], in comparison with Fe XIII [Fe12+] and Fe XIV [Fe13+], matches the dominance of the Fe10+ charge states measured by the Solar Wind Ion Composition Spectrometer, SWICS, on Ulysses, at –43° latitude at 4 AU, in March-April 2006, and Fe9+ and Fe10+ charge states measured by SWICS on the Advanced Composition Explorer, ACE, in the ecliptic plane at 1 AU, at the time of both eclipses. The remarkable correspondence between these two measurements establishes the first direct link between the distribution of charge states in the corona and in interplanetary space

A List of Galaxies for Gravitational Wave Searches

We present a list of galaxies within 100 Mpc, which we call the Gravitational Wave Galaxy Catalogue (GWGC), that is currently being used in follow-up searches of electromagnetic counterparts from gravitational wave searches. Due to the time constraints of rapid follow-up, a locally available catalogue of reduced, homogenized data is required. To achieve this we used four existing catalogues: an updated version of the Tully Nearby Galaxy Catalog, the Catalog of Neighboring Galaxies, the V8k catalogue and HyperLEDA. The GWGC contains information on sky position, distance, blue magnitude, major and minor diameters, position angle, and galaxy type for 53,255 galaxies. Errors on these quantities are either taken directly from the literature or estimated based on our understanding of the uncertainties associated with the measurement method. By using the PGC numbering system developed for HyperLEDA, the catalogue has a reduced level of degeneracies compared to catalogues with a similar purpose and is easily updated. We also include 150 Milky Way globular clusters. Finally, we compare the GWGC to previously used catalogues, and find the GWGC to be more complete within 100 Mpc due to our use of more up-to-date input catalogues and the fact that we have not made a blue luminosity cut.Comment: Accepted for publication in Classical and Quantum Gravity, 13 pages, 7 figure

Presynaptic Kainate Receptor Activation Preserves Asynchronous GABA Release Despite the Reduction in Synchronous Release from Hippocampal Cholecystokinin Interneurons

Inhibitory synaptic transmission in the hippocampus in mediated by a wide variety of different interneuron classes which are assumed to play different roles in network activity. Activation of presynaptic kainate receptors (KARs) has been shown to reduce inhibitory transmission but the interneuron class(es) at which they act is only recently beginning to emerge. Using paired recordings we show that KAR activation causes a decrease in presynaptic release from CCK- but not PV-containing interneurons and that this decrease is observed when pyramidal cells, but not interneurons, are the postsynaptic target. We also show that although the synchronous release component is reduced, the barrage of asynchronous GABA release from CCK interneurons during sustained firing is unaffected by KAR activation. This indicates that presynaptic KARs preserve and act in concert with asynchronous release to switch CCK interneurons from a phasic inhibition mode to produce prolonged inhibition during periods of intense activity

Reinstated episodic context guides sampling-based decisions for reward.

How does experience inform decisions? In episodic sampling, decisions are guided by a few episodic memories of past choices. This process can yield choice patterns similar to model-free reinforcement learning; however, samples can vary from trial to trial, causing decisions to vary. Here we show that context retrieved during episodic sampling can cause choice behavior to deviate sharply from the predictions of reinforcement learning. Specifically, we show that, when a given memory is sampled, choices (in the present) are influenced by the properties of other decisions made in the same context as the sampled event. This effect is mediated by fMRI measures of context retrieval on each trial, suggesting a mechanism whereby cues trigger retrieval of context, which then triggers retrieval of other decisions from that context. This result establishes a new avenue by which experience can guide choice and, as such, has broad implications for the study of decisions

From favorable atomic configurations to supershell structures: a new interpretation of conductance histograms

Title: From favorable atomic configurations to supershell structures: a new interpretation of conductance histograms Authors: A. Hasmy (IVIC), E. Medina (IVIC), P.A. Serena (CSIC,IVIC) Comments: 7 pages, 3 figures, cond-mat.anwar.10825 Subj-class: Soft Condensed MatterComment: 7 pages, 3 figuresSubject: fput HMS.tex HMS-FIG1.ps HMS-FIG2.ps HMS-FIG3.p