A Transferable Machine-Learning Model of the Electron Density

The electronic charge density plays a central role in determining the behavior of matter at the atomic scale, but its computational evaluation requires demanding electronic-structure calculations. We introduce an atom-centered, symmetry-adapted framework to machine-learn the valence charge density based on a small number of reference calculations. The model is highly transferable, meaning it can be trained on electronic-structure data of small molecules and used to predict the charge density of larger compounds with low, linear-scaling cost. Applications are shown for various hydrocarbon molecules of increasing complexity and flexibility, and demonstrate the accuracy of the model when predicting the density on octane and octatetraene after training exclusively on butane and butadiene. This transferable, data-driven model can be used to interpret experiments, initialize electronic structure calculations, and compute electrostatic interactions in molecules and condensed-phase systems

Probing the EBL evolution at high redshift using GRBs detected with the Fermi-LAT

The extragalactic background light (EBL), from ultraviolet to infrared wavelengths, is predominantly due to emission from stars, accreting black holes and reprocessed light due to Galactic dust. The EBL can be studied through the imprint it leaves, via $\gamma$-$\gamma$ absorption of high-energy photons, in the spectra of distant $\gamma$-ray sources. The EBL has been probed through the search for the attenuation it produces in the spectra of BL Lacertae (BL Lac) objects and individual $\gamma$-ray bursts (GRBs). GRBs have significant advantages over blazars for the study of the EBL especially at high redshifts. Here we analyze a combined sample of twenty-two GRBs, detected by the Fermi Large Area Telescope between 65 MeV and 500 GeV. We report a marginal detection (at the ~2.8 $\sigma$ level) of the EBL attenuation in the stacked spectra of the source sample. This measurement represents a first constraint of the EBL at an effective redshift of ~1.8. We combine our results with prior EBL constraints and conclude that Fermi-LAT is instrumental to constrain the UV component of the EBL. We discuss the implications on existing empirical models of EBL evolution.Comment: on behalf of the Fermi-LAT collaboration, accepted for publication on Ap

Damped Lyman-alpha Absorption Associated with an Early-Type Galaxy at Redshift z = 0.16377

We report new HST and ground-based observations of a damped Lyman-alpha absorption system toward the QSO 0850+4400. The redshift of the absorption system is z = 0.163770 and the neutral hydrogen column density of the absorption system is log N = 19.81 cm**-2. The absorption system is by far the lowest redshift confirmed damped Lyman-alpha absorption system yet identified, which provides an unprecedented opportunity to examine the nature, impact geometry, and kinematics of the absorbing galaxy in great detail. The observations indicate that the absorption system is remarkable in three respects: First, the absorption system is characterized by weak metal absorption lines and a low metal abundance, possibly less than 4% of the solar metal abundance. This cannot be explained as a consequence of dust, because the neutral hydrogen column density of the absorption system is far too low for obscuration by dust to introduce any significant selection effects. Second, the absorption system is associated with a moderate-luminosity early-type S0 galaxy, although the absorption may actually arise in one of several very faint galaxies detected very close to the QSO line of sight. Third, the absorbing material moves counter to the rotating galaxy disk, which rules out the possibility that the absorption arises in a thin or thick co-rotating gaseous disk. These results run contrary to the expectation that low-redshift damped Lyman-alpha absorption systems generally arise in the gas- and metal-rich inner parts of late-type spiral galaxies. We suggest instead that mounting evidence indicates that low-redshift galaxies of a variety of morphological types may contain significant quantities of low metal abundance gas at large galactocentric distances.Comment: 15 pages, LaTex, 4 figures, to be published in The Astronomical Journa

Group i metabotropic glutamate receptors: A potential target for regulation of proliferation and differentiation of an immortalized human neural stem cell line

© 2014 Nordic Association for the Publication of BCPT (former Nordic Pharmacological Society). Human neural stem cells (NSCs) from the developing embryo or the subventricular zone of the adult brain can potentially elicit brain repair after injury or disease, either via endogenous cell proliferation or by cell transplantation. Profound knowledge of the diverse signals affecting these cells is, however, needed to realize their therapeutic potential. Glutamate and group I metabotropic glutamate receptors (mGluRs) affect proliferation and survival of rodent NSCs both during embryonic and post-natal development. To investigate the role of group I mGluRs (mGluR1 and mGluR5) on human NSCs, we differentiated an immortalized, forebrain-derived stem cell line in the presence or absence of glutamate and with addition of either the group I mGluR agonist DHPG or the selective antagonists, MPEP (mGluR5) and LY367385 (mGluR1). Characterization of differentiated cells revealed that both mGluR1 and mGluR5 were present on the cells. Addition of glutamate to the growth medium significantly increased cell proliferation and reduced cell death, resulting in increased cell numbers. In the presence of glutamate, selective activation of group I mGluRs reduced gliogenesis, whereas selective inhibition of group I mGluRs reduced neurogenesis. Our results substantiate the importance of glutamate signalling in the regulation of human NSCs and may as such be applied to promote proliferation and neuronal differentiation.This research was supported by the Danish Parkinson Association, IMK Almene Fond, Hørslev-Fonden, Kirsten og Freddy Johansens Fond, Grosserer Brogaard og Hustrus Mindefond and Fonden for Lægevidenskabens Fremme.Peer Reviewe

Clarifying the muddy concept of home healthcare coordination: A comprehensive theoretical framework.

Effective healthcare coordination is vital when such care is provided as a collaborative effort by many individuals and their task activities are interdependent. Coordination is necessary to ensure that care not only meets the needs of patients, but also avoids negative consequences for them due to omitted, inefficient, unnecessary, or even incorrect treatments. It also helps conserve resources. This has contributed to a rapid increase in articles on this subject. Still, while care coordination topics are gaining the attention of researchers, there are a number of issues experienced, including the delineation of limitations, inconsistent definitions, and problems with measurement. Therefore, the aim of this article is to refine the concept of homecare coordination and provide a comprehensive theoretical framework, illustrated with examples from practice. Focusing on this goal, we have reviewed the extant literature on the subject to develop a theoretical homecare coordination framework. The first intermediary goal was to integrate relevant concepts across multiple theories and frameworks into a unified synthesis. We do so in two parts: (1) analysis of extant coordination frameworks and theories; and (2) the presentation of our newly developed theoretical framework for homecare coordination. The new framework differentiates clearly between coordination as a process—i.e., what people do to coordinate and coordination as an outcome—i.e., the state of coordination. Applying this distinction to both, measurement and interpretation of results helps avoid misleading conclusions. As a research outcome, our framework builds upon the extant coordination literature, considers the complex relationships among the various coordination-related factors and, while focusing on homecare, is applicable to various healthcare settings in general. A nuanced differentiation and explanation of the elements involved enable a more consistent operationalization of the coordination concept. Additionally, as they explicitly address the healthcare system's micro, meso, and macro levels, they can be applied across diverse healthcare settings to investigate homecare coordination

EL HIDRÓGENO Y EL FUTURO DE LOS COMBUSTIBLES

Mucho se habla sobre el advenimiento de las energías limpias. ¿Estamos realmente cerca de conseguirlo? ¿Cuáles son las alternativas actuales y los desafíos pendientes? En algún momento todos hemos escuchado que los combustibles fósiles están a punto de agotarse y que el hidrógeno es la fuente de energía del futuro. Este es un comentario que viene acompañado de otro que dice que, además, los combustibles fósiles contaminan mientras que el hidrógeno produce energía limpia. Pues bien, la verdad es que estas cosas no son tan así. El hidrógeno no es una fuente de energía, sino un posible vector energético

Search for the imprint of axion-like particles in the highest-energy photons of hard γ\gamma-ray blazars

Axion-like particles (ALPs), predicted in theories beyond the Standard Model, can have observational effects on the transparency of the Universe to $\gamma$ rays in the presence of magnetic fields. In this work, we search for effects compatible with the existence of ALPs with 80 months of data from the ${\it Fermi}$ Large Area Telescope, by comparing the distributions of observed highest energy photons from sources beyond redshifts of z $\geq$ 0.1 with theoretical predictions in the presence of ALPs. We find no evidence for an increased $\gamma$-ray transparency due to ALPs and therefore we set limits on the ALPs parameters assuming a value of the intergalactic magnetic field strength of 1 nG. Photon-ALP couplings above $10^{-11}$ GeV$^{-1}$ are excluded for ALP masses $m_{a}$ $\lesssim3.0$ neV. These limits exclude a region of the parameter space not covered by other $\gamma$-ray telescopes and are compatible with constraints imposed by other experiments.Comment: 23 pages, 8 figures, 2 table

Photoperiodic modulation of circadian functions in Antarctic krill Euphausia superba Dana, 1850 (Euphausiacea)

An endogenous circadian clock influences metabolic output rhythms in the Antarctic krill (Euphausia superba Dana, 1850), a key species in the Southern Ocean ecosystem. Seasonal changes in photoperiod in Antarctica, ranging from midnight sun (24 h light) during mid-summer to very short days (3\u20134 h light) during mid-winter, represent a challenge for the synchronization of the krill circadian clock. We analyzed clock gene activity and clock output functions in krill exposed to different light conditions during a long-term photoperiodic simulation in the laboratory. In simulated early-autumn (light/dark or LD 16:8) and late-winter (LD 8:16) conditions, the circadian clock of krill was functional and the metabolic output was synchronized to the light/dark cycle, the clock genes Esper and Esclk peaked in antiphase around simulated dusk/dawn and most metabolic-related genes showed upregulation around simulated dusk. In contrast, in simulated mid-summer (light/light or LL) and mid-winter (LD 3:21) conditions, the synchronization of the circadian clock and the metabolic output appeared to be weaker, with clock gene expression becoming arrhythmic and upregulation of metabolic genes occurring at different times during the day. Early-autumn and late-winter photoperiodic cues in the laboratory thus seem to be sufficient to entrain the krill clock and promote metabolic synchronization, whereas midwinter and mid-summer photoperiodic cues seem to be insufficient for krill entrainment. Krill in the field may overcome the seasonal lack of overt photoperiodic cycle occurring during midsummer and mid-winter by using alternative light-related Zeitgebers (i.e., varying light intensity rather than the presence or absence of light) to promote basic homeostatic rhythms over 24 h

Comportamiento térmico en ríos mediterráneos andinos de la zona centro-sur de Chile

Despite of the importance of temperature in the fluvial ecosystems, the knowledge of its spatial and temporal variability in Andean rivers is limited, thus it is necessary to clarify the relative importance of site-specific factors in controlling the temperature of rivers. The aim of this research was to characterize the thermal regime of five Andean streams through an altitudinal gradient. The results show that there is a spatial and temporal variability in water temperature with a relatively rapid rise in temperature in mid-December, being stable in January and February, and a rapid decrease at the beginning of March and April. The thermal heterogeneity recorded in the high Andean zone of the Biobio River Basin makes it clear that geomorphology characteristics of each site are important in regulating water temperature, associated mainly with the altitude and shade; this latter mainly generated by high mountains and in some cases by the timberline. It is known that thermal variability, mainly the maximum and minimum mean temperatures; causing severe stress on stenotherm organisms. Therefore, a deeper knowledge of the river temperature is essential for the management and future protection of the Andean freshwater ecosystems to mitigate the impacts associated to the global warming.A pesar de la importancia que tiene la temperatura en los sistemas fluviales, el conocimiento de su variabilidad espacio-temporal en ríos de Chile es limitado. Tales estudios son necesarios para aclarar la importancia relativa de los factores locales a la hora de controlar la temperatura de los ríos. La presente investigación tuvo por objetivo caracterizar el régimen térmico de cinco ríos andinos de la región del Biobío a través de un gradiente altitudinal. Los resultados muestran que existe una variabilidad espacio-temporal en la temperatura del agua con un incremento relativamente rápido de la temperatura a mediados de diciembre, manteniéndose en enero y febrero, para disminuir rápidamente a principio de marzo y abril. La heterogeneidad térmica encontrada en la zona andina de la cuenca del río Biobío deja de manifiesto que las características geomorfológicas de cada sitio son relevantes en la regulación de la temperatura del agua, asociada principalmente a la altitud y sombra, esta última generada principalmente por las altas montañas y en algunos casos por la vegetación arbórea. Se prevé que cambios principalmente en las temperaturas medias máximas y mínimas podrían ocasionar un severo estrés en organismos estenotermos. Por lo tanto, un conocimiento detallado de la temperatura en ríos andinos podría proveer de información necesaria para direccionar la mitigación de los impactos asociados al calentamiento global

Antarctic circumpolar current impacts on internal wave life cycles

Author Posting. © American Geophysical Union, 2021. This article is posted here by permission of American Geophysical Union for personal use, not for redistribution. The definitive version was published in Geophysical Research Letters 48(8), (2021): e2020GL089471, https://doi.org/10.1029/2020GL089471.Major gaps exist in our understanding of the pathways between internal wave generation and breaking in the Southern Ocean, with important implications for the distribution of internal wave-driven mixing, the sensitivity of ocean mixing rates and patterns to changes in the ocean environment, and the necessary ingredients of mixing parameterizations. Here we assess the dominant processes in internal wave evolution by characterizing wave and mesoscale flow scales based on full-depth in situ measurements in a Southern Ocean mixing hot spot and a ray tracing calculation. The exercise highlights the importance of Antarctic Circumpolar Current jets as a dominant influence on internal wave life cycles through advection, the modification of wave characteristics via wave-mean flow interactions, and the set-up of critical layers for both upward- and downward-propagating waves. Our findings suggest that it is important to represent mesoscale flow impacts in parameterizations of internal wave-driven mixing in the Southern Ocean.The SOFine project was funded by the UK Natural Environmental Research Council (NERC) (grant NE/G001510/1). S. Waterman is currently supported by the National Science and Engineering Research Council of Canada (NSERC) Discovery Grant Program (NSERC-2020-05799). A. Meyer acknowledges current support from the ARC Centre of Excellence for Climate Extremes (CE170100023) and previous support from the joint CSIRO-University of Tasmania Quantitative Marine Science (QMS) program. A. N. Garabato acknowledges the support of the Royal Society and the Wolfson Foundation