764 research outputs found

    Twisted bilayer graphene revisited: minimal two-band model for low-energy bands

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    An accurate description of the low-energy electronic bands in twisted bilayer graphene (tBLG) is of great interest due to their relation to correlated electron phases, such as superconductivity and Mott-insulator behavior at half-filling. The paradigmatic model of Bistritzer and MacDonald [PNAS 108, 12233 (2011)], based on the moir\'e pattern formed by tBLG, predicts the existence of "magic angles" at which the Fermi velocity of the low-energy bands goes to zero, and the bands themselves become dispersionless. Here, we reexamine the low-energy bands of tBLG from the ab initio electronic structure perspective, motivated by features related to the atomic relaxation in the moir\'e pattern, namely circular regions of AA stacking, triangular regions of AB/BA stacking and domain walls separating the latter. We find that the bands are never perfectly flat and the Fermi velocity never vanishes, but rather a "magic range" exists where the lower band becomes extremely flat and the Fermi velocity attains a non-zero minimum value. We propose a simple (2+2)(2+2)-band model, comprised of two different pairs of orbitals, both on a honeycomb lattice: the first pair represents the low-energy bands with high localization at the AA sites, while the second pair represents highly dispersive bands associated with domain-wall states. This model gives an accurate description of the low-energy bands with few (13) parameters which are physically motivated and vary smoothly in the magic range. In addition, we derive an effective two-band hamiltonian which also gives an accurate description of the low-energy bands. This minimal two-band model affords a connection to a Hubbard-like description of the occupancy of sub-bands and can be used a basis for exploring correlated states

    Direct Access to β-Fluorinated Aldehydes by Nitrite-Modified Wacker Oxidation

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    An aldehyde-selective Wacker-type oxidation of allylic fluorides proceeds with a nitrite catalyst. The method represents a direct route to prepare β-fluorinated aldehydes. Allylic fluorides bearing a variety of functional groups are transformed in high yield and very high regioselectivity. Additionally, the unpurified aldehyde products serve as versatile intermediates, thus enabling access to a diverse array of fluorinated building blocks. Preliminary mechanistic investigations suggest that inductive effects have a strong influence on the rate and regioselectivity of the oxidation

    Looking for Pure Rotational H_2 Emission from Protoplanetary Disks

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    We report on a limited search for pure-rotational molecular hydrogen emission associated with young, pre-main-sequence stars. We looked for H_2 v=0 J = 3->1 and J = 4->2 emission in the mid-infrared using the Texas Echelon-Cross-Echelle Spectrograph (TEXES) at NASA's 3m Infrared Telescope Facility. The high spectral and spatial resolution of our observations lead to more stringent limits on narrow line emission close to the source than previously achieved. One star, AB Aur, shows a possible (2sigma) H_2 detection, but further observations are required to make a confident statement. Our non-detections suggest that a significant fraction, perhaps all, of previously reported H_2 emission towards these objects could be extended on scales of 5" or more.Comment: 14 pages including 2 figures. Accepted by ApJ Letter

    Augmented Reality Technician Assistance Program

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    The Augmented Reality Technician Assistance Program is a proof-of-concept project for allowing a remote expert to communicate with and assist a field technician in completing procedures with which the technician may be unfamiliar. For example, an expert in Navy aircraft maintenance could advise an Air Force flight mechanic about performing repairs or maintenance on Navy aircraft. The end goal of our Cedarville computer science capstone project is to create an experimental prototype to deliver to the Air Force Research Laboratory. In our prototype the expert uses a Microsoft Surface Pro tablet to communicate via marked up still images with a Hololens-enabled field technician. As a wearable computer, the Hololens provides the technician a hands-free advantage over traditional devices, because it’s interface does not use typical input devices such as a mouse and keyboard. The advantage of the Surface Pro is that it allows the expert to mark up instructional images naturally with the stylus, providing better precision for the annotations

    Football in the community schemes: Exploring the effectiveness of an intervention in promoting healthful behaviour change

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    This study aims to examine the effectiveness of a Premier League football club’s Football in the Community (FitC) schemes intervention in promoting positive healthful behaviour change in children. Specifically, exploring the effectiveness of this intervention from the perspectives of the participants involved (i.e. the researcher, teachers, children and coaches). A range of data collection techniques were utilized including the principles of ethnography (i.e. immersion, engagement and observations), alongside conducting focus groups with the children. The results allude to the intervention merely ‘keeping active children active’ via (mostly) fun, football sessions. Results highlight the important contribution the ‘coach’ plays in the effectiveness of the intervention. Results relating to working practice (i.e. coaching practice and coach recruitment) are discussed and highlighted as areas to be addressed. FitC schemes appear to require a process of positive organizational change to increase their effectiveness in strategically attending to the health agenda

    Direct Access to β-Fluorinated Aldehydes by Nitrite-Modified Wacker Oxidation

    Get PDF
    An aldehyde-selective Wacker-type oxidation of allylic fluorides proceeds with a nitrite catalyst. The method represents a direct route to prepare β-fluorinated aldehydes. Allylic fluorides bearing a variety of functional groups are transformed in high yield and very high regioselectivity. Additionally, the unpurified aldehyde products serve as versatile intermediates, thus enabling access to a diverse array of fluorinated building blocks. Preliminary mechanistic investigations suggest that inductive effects have a strong influence on the rate and regioselectivity of the oxidation

    Astrocyte response to motor neuron injury promotes structural synaptic plasticity via STAT3-regulated TSP-1 expression.

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    The role of remote astrocyte (AC) reaction to central or peripheral axonal insult is not clearly understood. Here we use a transgenic approach to compare the direct influence of normal with diminished AC reactivity on neuronal integrity and synapse recovery following extracranial facial nerve transection in mice. Our model allows straightforward interpretations of AC-neuron signalling by reducing confounding effects imposed by inflammatory cells. We show direct evidence that perineuronal reactive ACs play a major role in maintaining neuronal circuitry following distant axotomy. We reveal a novel function of astrocytic signal transducer and activator of transcription-3 (STAT3). STAT3 regulates perineuronal astrocytic process formation and re-expression of a synaptogenic molecule, thrombospondin-1 (TSP-1), apart from supporting neuronal integrity. We demonstrate that, through this new pathway, TSP-1 is responsible for the remote AC-mediated recovery of excitatory synapses onto axotomized motor neurons in adult mice. These data provide new targets for neuroprotective therapies via optimizing AC-driven plasticity.This is the final version. It was first published in Nature Communications here: http://www.nature.com/ncomms/2014/140711/ncomms5294/abs/ncomms5294.html

    Some considerations for the communication of results of air pollution health effects tracking

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    Communicating effectively and efficiently on air quality and its health impacts is an important but difficult and complex task. It requires careful consideration of the audience one wants to reach, the messages one is trying to present, the venue through which the message will be delivered. The audience, context, technique, and content factors may affect how well it is heard and how appropriately it is interpreted. In this short paper, I describe many of these concerns and provide some suggestions for how best to address them. However, since every audience differs in goals, characteristics, and nature, what is most important is implementing an effective communications program. This program should include frequent two-way communication, repeated and on-going evaluation of how well the audience understands the messages, and consideration of how to improve the delivery
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