Thermally-activated charge reversibility of gallium vacancies in GaAs

The dominant charge state for the Ga vacancy in GaAs has been the subject of a long debate, with experiments proposing $-$1, $-$2 or $-$3 as the best answer. We revisit this problem using {\it ab initio} calculations to compute the effects of temperature on the Gibbs free energy of formation, and we find that the thermal dependence of the Fermi level and of the ionization levels lead to a reversal of the preferred charge state as the temperature increases. Calculating the concentrations of gallium vacancies based on these results, we reproduce two conflicting experimental measurements, showing that these can be understood from a single set of coherent LDA results when thermal effects are included.Comment: 4 pages, 4 figure

Detecting long-lasting transients of earthquake activity on a fault system by monitoring apparent stress, ground motion and clustering

Damaging earthquakes result from the evolution of stress in the brittle upper-crust, but the understanding of the mechanics of faulting cannot be achieved by only studying the large ones, which are rare. Considering a fault as a complex system, microearthquakes allow to set a benchmark in the system evolution. Here, we investigate the possibility to detect when a fault system starts deviating from a predefined benchmark behavior by monitoring the temporal and spatial variability of different micro-and-small magnitude earthquakes properties. We follow the temporal evolution of the apparent stress and of the event-specific residuals of ground shaking. Temporal and spatial clustering properties of microearthquakes are monitored as well. We focus on a fault system located in Southern Italy, where the Mw 6.9 Irpinia earthquake occurred in 1980. Following the temporal evolution of earthquakes parameters and their time-space distribution, we can identify two long-lasting phases in the seismicity patterns that are likely related to high pressure fluids in the shallow crust, which were otherwise impossible to decipher. Monitoring temporal and spatial variability of micro-to-small earthquakes source parameters at near fault observatories can have high potential as tool for providing us with new understanding of how the machine generating large earthquakes works

Non-contact ultrasound characterization of paper substrates

Different kinds of paper varying in basis weight, thickness, etc. and finishing characteristics such as cast, gloss, matte were analyzed with and without deposited ink. A 1.7 MHz Ultran non-contact ultrasound focused transducer was operated in the pulse-echo mode to investigate the samples following a raster scan on a 1.5 cm by 1.5 cm area. Both sides of each sample were imaged under this protocol. A pre-designed pattern consisting of some text and a rectangular solid block was printed on the front side of the samples using a Xerox Nuvera120 laser printer and the imaging protocol repeated. C-scan images created from the envelope detected data provide a promising means to investigate and visually differentiate the mechanical properties of the samples as ink is deposited, as well as to differentiate front and back sides of each sample. The second normalized intensity moment and Signal to Noise Ratio (SNR) of the signal envelope are investigated to test their validity to discriminate between different kinds of paper as well as differences in scattering properties when ink is deposited

Merging Active and Passive Data Sets in Travel-Time Tomography: The Case Study of Campi Flegrei Caldera (Southern Italy)

We propose a strategy for merging both active and passive data sets in linearized tomographic inversion. We illustrate this in the reconstruction of 3D images of a complex volcanic structure, the Campi Flegrei caldera, located in the vicinity of the city of Naples, southern Italy. The caldera is occasionally the site of significant unrests characterized by large ground uplifts and seismicity. The P and S velocity models of the caldera structure are obtained by a tomographic inversion based on travel times recorded during two distinct experiments. The first data set is composed of 606 earthquakes recorded in 1984 and the second set is composed of recordings for 1528 shots produced during the SERAPIS experiment in 2001. The tomographic inversion is performed using an improved method based on an accurate finite-difference traveltime computation and a simultaneous inversion of both velocity models and earthquake locations. In order to determine the adequate inversion parameters and relative data weighting factors, we perform massive synthetic simulations allowing one to merge the two types of data optimally. The proper merging provides high resolution velocity models, which allow one to reliably retrieve velocity anomalies over a large part of the tomography area. The obtained images confirm the presence of a high P velocity ring in the southern part of the bay of Pozzuoli and extends its trace inland as compared to previous results. This annular anomaly represents the buried trace of the rim of the Campi Flegrei caldera. Its shape at 1.5 km depth is in good agreement with the location of hydrothermalized lava inferred by gravimetric data modelling. The Vp/Vs model confirms the presence of two characteristic features. At about 1 km depth a very high Vp/Vs anomaly is observed below the town of Pozzuoli and is interpreted as due to the presence of rocks that contain fluids in the liquid phase. A low Vp/Vs body extending at about 3–4 km depth below a large part of the caldera is interpreted as the top of formations that are enriched in gas under supercritical conditions

Converted phase identification and retrieval of Vp/Vs ratios from move-out reflection analysis: application to the Campi Flegrei caldera

Here, we propose a method for the determination of Vp/Vs ratios in a horizontally layered propagation media using maximization of a coherency function along theoretical travel-times of PS reflected phases. The theoretical travel-times are computed using the information about the propagation media that is extracted by velocity analysis or by topographic analysis performed on the first arrivals. The method is also a valid tool for the identification of the PS phases associated with a fixed seismic reflector, and it is particularly suitable for data that is stored in common mid-point and common conversion point bin- ning; for this kind of data the hypothesis of horizontally and layered media can usually be verified. We applied the method to both simulated and real datasets. The use of the real data that was acquired in the Campi Flegrei caldera (southern Italy) allowed us to estimate a relatively high Vp/Vs ratio (3.5 ± 0.6) for a very shallow layer (maximum depth, 600 m). This hypothesis has been tested by theoretical rock physical modeling of the Vp/Vs ratios as a function of porosity, suggesting that the shallow layer appears to be formed of unconsolidated, water-saturated, volcanic and marine sediments that filled Pozzuoli Bay during the post-caldera activity

A series of new conjugated oligothiophenes for organic electronics

Thiophene oligomers and polymers can be found in a huge number of materials with applications in the field of Organic Electronics. Chemical and electrochemical syntheses along with electrochemical studies and complete characterization of a series of new conjugated oligothiophene derivatives are reported. Two different molecular architectures, D-A (donor-acceptor) and A-D-A (acceptor-donor-acceptor), were taken into account. The results from voltammetric experiments and optical studies confirm the close relationship between the structure of these compounds and their electrochemical behaviour. This series of oligothiophenes shows low bandgaps, a mandatory requirement for their use in Organic Electronics, and, clearly, they are promising candidates for future synthetic studies in order to modify their optical and electrochemical properties to achieve better performances as organic semiconductors

High performance liquid chromatography coupled with mass spectrometry for/and nanomaterials: an overview

The story of mass spectrometry applied to the nanoparticles world is very young but actually it is expected to evolve as one of the most powerful tool for the characterization of the smaller-size nanoparticles in terms of composition, size, shape, surface chemistry, because of its versatility, sensitivity, reliability and the possibility to be coupled with high performance chromatographic separation techniques. A short overview on different fields where liquid chromatography coupled with mass spectrometry, nanomaterials and nanotechnology come together is herein given

Negotiating sexuality and masculinity in school sport: An autoethnography

This autoethnography explores challenging and ethically sensitive issues around sexual orientation, sexual identity and masculinity in the context of school sport. Through storytelling, I aim to show how sometimes ambiguous encounters with heterosexism, homophobia and hegemonic masculinity through sport problematise identity development for young same-sex attracted males. By foregrounding personal embodied experience, I respond to an absence of stories of gay and bisexual experiences among males in physical education and school sport, in an effort to reduce a continuing sense of Otherness and difference regarding same-sex attracted males. I rely on the story itself to express the embodied forms of knowing that inhabit the experiences I describe, and resist a finalising interpretation of the story. Instead, I offer personal reflections on particular theoretical and methodological issues which relate to both the form and content of the story

RIP1-HAT1-SirT complex identification and targeting in treatment and prevention of cancer

Purpose: Alteration in cell death is a hallmark of cancer. A functional role regulating survival, apoptosis, and necroptosis has been attributed to RIP1/3 complexes.Experimental Design: We have investigated the role of RIP1 and the effects of MC2494 in cell death induction, using different methods as flow cytometry, transcriptome analysis, immunoprecipitation, enzymatic assays, transfections, mutagenesis, and in vivo studies with different mice models.Results: Here, we show that RIP1 is highly expressed in cancer, and we define a novel RIP1/3-SIRT1/2-HAT1/4 complex. Mass spectrometry identified five acetylations in the kinase and death domain of RIP1. The novel characterized pan-SIRT inhibitor, MC2494, increases RIP1 acetylation at two additional sites in the death domain. Mutagenesis of the acetylated lysine decreases RIP1-dependent cell death, suggesting a role for acetylation of the RIP1 complex in cell death modulation. Accordingly, MC2494 displays tumor-selective potential in vitro, in leukemic blasts ex vivo, and in vivo in both xenograft and allograft cancer models. Mechanistically, MC2494 induces bona fide tumor-restricted acetylated RIP1/caspase-8-mediated apoptosis. Excitingly, MC2494 displays tumor-preventive activity by blocking 7,12-dimethylbenz(α)anthracene-induced mammary gland hyperproliferation in vivoConclusions: These preventive features might prove useful in patients who may benefit from a recurrence-preventive approach with low toxicity during follow-up phases and in cases of established cancer predisposition. Thus, targeting the newly identified RIP1 complex may represent an attractive novel paradigm in cancer treatment and prevention