1,019 research outputs found

    Frontispiece: Lanthanide tetrazolate complexes combining single-molecule magnet and luminescence properties: The effect of the replacement of tetrazolate N3 by β-Diketonate Ligands on the anisotropy energy barrier

    Get PDF
    Three new sets of mononuclear LnIII complexes of general formulas [LnL3]·CH3OH (LnIII = Yb (1), Er (2), Dy (3), Gd (4) and Eu (5)), [LnL2(tmh)(CH3OH)]·n H2O·m CH3OH (LnIII = Yb (1b), Er (2b), Dy (3b), Gd (4b)) and [LnL2(tta)(CH3OH)]·CH3OH (LnIII = Yb (1c), Er (2c), Dy (3c), Gd (4c) have been prepared from the reaction of Ln(CF3SO3)·nH2O salts with the tridentate ligand 2-(tetrazolate-5-yl)-1,10- phenanthroline (HL). For the two latter sets, additionally with the respective β- diketonate ligands 2,2,6,6-tetramethylheptanoate (tmh) or 2-thenoyltrifluoroacetonate (tta). In the [LnL3]·CH3OH complexes the LnIII ions are coordinated to three phenanthroline-tetrazolate ligands showing a LnN9 coordination sphere. Dynamic ac magnetic measurements for 1 – 3 reveal that these complexes only exhibit single molecule magnet (SMM) behaviour when an external dc magnetic field is applied, with Ueff values of 11.7 K (1), 16.0 K (2) and 20.2 K (3). When the tridentate phenanthrolinetetrazolate ligand is replaced by one molecule of methanol and the β-diketonate ligand tmh (1b – 3b) or tta (1c – 3c), a significant increase in Ueff occurs and, in the case of the DyIII derivates 3b and 3c, out-of-phase χ’’ signals below 15 K and 10 K, respectively, are observed under zero-dc magnetic field. CASSCF+RASSI ab initio calculations performed on the DyIII derivates support the experimental results. Thus, for 3 the ground Kramers’ doublet is far from being axial and the first excited state is found to be very close in energy to the ground state so the relaxation barrier in this case is almost negligible. Conversely, for 3b and 3c, the ground Kramers’ doublet is axial with a small quantum tunneling of the magnetization (QTM) and the energy difference between the ground and first Kramers’ doublets is much higher, which allows these compounds to behave as SMMs at zero-field. Moreover, these calculations support the larger Ueff observed for 3b compared to 3c. Additionally, the solid-state photophysical properties of 1, 2, 4 and 5 show that the phenanthroline tetrazolate ligand can act as an effective antenna to sensitize the characteristic YbIII, ErIII and EuIII emissions through an energy transfer process

    Lanthanide tetrazolate complexes combining single-molecule magnet and luminescence properties: the effect of the replacement of tetrazolate n3 by β-diketonate ligands on the anisotropy energy barrier

    Get PDF
    Three new sets of mononuclear LnIII complexes of general formulas [LnL3]⋅CH3OH [LnIII=Yb (1), Er (2), Dy (3), Gd (4), and Eu (5)], [LnL2(tmh)(CH3OH)]⋅n H2O⋅m CH3OH [LnIII=Yb (1 b), Er (2 b), Dy (3 b), Gd (4 b)], and [LnL2(tta)(CH3OH)]⋅CH3OH [LnIII=Yb (1 c), Er (2 c), Dy (3 c), Gd (4 c)] were prepared by the reaction of Ln(CF3SO3)⋅n H2O salts with the tridentate ligand 2-(tetrazol-5-yl)-1,10-phenanthroline (HL) and, for the last two sets, additionally with the β-diketonate ligands 2,2,6,6-tetramethylheptanoate (tmh) and 2-thenoyltrifluoroacetonate (tta), respectively. In the [LnL3]⋅CH3OH complexes the LnIII ions are coordinated to three phenanthroline tetrazolate ligands with an LnN9 coordination sphere. Dynamic ac magnetic measurements on 1–3 reveal that these complexes only exhibit single-molecule magnet (SMM) behavior when an external dc magnetic field is applied, with Ueff values of 11.7 K (1), 16.0 K (2), and 20.2 K (3). When the tridentate phenanthroline tetrazolate ligand is replaced by one molecule of methanol and the β-diketonate ligand tmh (1 b–3 b) or tta (1 c–3 c), a significant increase in Ueff occurs and, in the case of the DyIII complexes 3 b and 3 c, out-of-phase χ′′ signals below 15 and 10 K, respectively, are observed in zero dc magnetic field. CASSCF+RASSI ab initio calculations performed on the DyIII complexes support the experimental results. Thus, for 3 the ground Kramers’ doublet is far from being axial and the first excited state is found to be very close in energy to the ground state, so the relaxation barrier in this case is almost negligible. Conversely, for 3 b and 3 c, the ground Kramers’ doublet is axial with a small quantum tunneling of the magnetization, and the energy difference between the ground and first Kramers’ doublets is much higher, which allows these compounds to behave as SMMs at zero field. Moreover, these calculations support the larger Ueff observed for 3 b compared to 3 c. Additionally, the solid-state photophysical properties of 1, 2, 4, and 5 show that the phenanthroline tetrazolate ligand can act as an effective antenna to sensitize the characteristic YbIII, ErIII, and EuIII emissions through an energy-transfer process

    Evidence of recent ruptures in the central faults of the Acambay Graben (central Mexico)

    Get PDF
    The Acambay Graben, within the central part of the Trans-Mexican Volcanic Belt, is one of the major sources of continental earthquakes in Mexico. To date, the activity and paleoseismological history of the axial faults of the graben are not well constrained. We provide morphological, structural and sedimentological evidence of the seismogenic nature of two of the axial structures, the Temascalcingo and the Tepuxtepec fault systems. Faults consist of multiple parallel scarps with en echelon and horse-splay patterns. Fault systems extend for 60 km and displace Quaternary to Upper Miocene volcanic edifices and volcano-sedimentary materials. Surface lengths of individual fault traces range between 3 and 25 km, and observed throws reach a minimum of 150-200 m. The long-term and short-term slip rate of the Temascalcingo fault system in the studied section presents similar values, ranging from 0.06 ± 0.02 (minimum long term) to 0.12 ± 0.02 mm y−1 (maximum value of average short-term). Only the long-term slip rate of the Tepuxtepec system could be constrained in 0.01-0.02 mm/y, being a minimum estimate. The Holocene fault rupture history at two sites provided evidence of six ruptures since 12,500-11,195 BCE, among which three ruptures should have occurred between 11,847 ± 652 BCE and 11,425 ± 465 BCE Variable single event displacements (SEDs, between 6 and 77) are interpreted as the result of fault interdependences and/or the interaction with the latest volcanic activity. Also, small displacements triggered by activity on other faults probably contributed to slip variability, i.e., faults display primary and secondary behavior

    X-ray detection with Micromegas with background levels below 106^{-6} keV1^{-1}cm2^{-2}s1^{-1}

    Full text link
    Micromegas detectors are an optimum technological choice for the detection of low energy x-rays. The low background techniques applied to these detectors yielded remarkable background reductions over the years, being the CAST experiment beneficiary of these developments. In this document we report on the latest upgrades towards further background reductions and better understanding of the detectors' response. The upgrades encompass the readout electronics, a new detector design and the implementation of a more efficient cosmic muon veto system. Background levels below 106^{-6}keV1^{-1}cm2^{-2}s1^{-1} have been obtained at sea level for the first time, demonstrating the feasibility of the expectations posed by IAXO, the next generation axion helioscope. Some results obtained with a set of measurements conducted in the x-ray beam of the CAST Detector Laboratory will be also presented and discussed

    A Chiral Bipyrimidine-Bridged Dy2 SMM: A Comparative Experimental and Theoretical Study of the Correlation Between the Distortion of the DyO6N2 Coordination Sphere and the Anisotropy Barrier

    Get PDF
    Chiral bipyrimidine-bridged dinuclear LnIII complexes of general formula [(μ-bipym){((+)-tfacam)3Ln}2] and [(μ-bipym){((-)-tfacam)3Ln}2], have been prepared from the assembly of Ln(AcO)3·nH2O (LnIII = Dy, Gd), (+)/(−)-3-(trifluoroacetyl)camphor enantiopure ligands ((+)/(-)-Htfacam) and bipyrimidine (bipym). The structure and chirality of these complexes have been supported by single-crystal X-Ray diffraction and circular dichroism. The study of the magnetic properties of the GdIII complexes revealed a very weak antiferromagnetic interaction between the GdIII ions through the bipyrimidine bridging ligand. Ab initio CASSCF calculations indicated that the ground Kramers doublet (KD) of both DyIII centers is almost purely axial with the anisotropy axis located close to the two tfacam−ligands at opposite sides of each DyIIIatom, which create an axial crystal field. In keeping with this, ac dynamic measurements indicated slow relaxation of the magnetization at zero field with Ueff = 55.1 K, a pre-exponential factor of τo = 2.17·10−6 s and τQTM = 8 μs. When an optimal dc field of 0.1 T is applied, QTM is quenched and Ueff increases to 75.9 K with τo = 6.16 × 10−7 s. The DyN2O8 coordination spheres and SMM properties of [(μ-bipym){((+)-tfacam)3Ln}2] and their achiral [(Dy(b-diketonate)3)2(μ-bpym)]analogous have been compared and a magneto-structural correlation has been established, which has been supported by theoretical calculations.ID-O, JH, and EC are grateful to Ministerio de Economía y Competitividad (MINECO) for Project CTQ2014-56312-P, the Junta de Andalucía (FQM-195 and the Project of excellence P11-FQM-7756) and the University of Granada. A part of this work has been made at HFLSM, IMR, Tohoku University. IDO also acknowledges support by COLABS. GR would like to thank SERB (EMR/2014/000247) for financial support. SDthanks UGC for Senior Research Fellowship. AC thanks the Marie Curie COFUND Action from the European Commission for co-financing his postdoctoral fellowship

    Thematic Trends in Complementary and Alternative Medicine Applied in Cancer-Related Symptoms

    Get PDF
    Purpose: The main goal of this study is to discover the scientific evolution of Cancer-Related Symptoms in Complementary and Alternative Medicine research area, analyzing the articles indexed in the Web of Science database from 1980 to 2013. Design/Methodology/Approach: A co-word science mapping analysis is performed under a longitudinal framework (1980 to 2013). The documental corpus is divided into two subperiods, 1980–2008 and 2009–2013. Thus, the performance and impact rates, and conceptual evolution of the research field are shown. Findings: According to the results, the co-word analysis allows us to identify 12 main thematic areas in this emerging research field: anxiety, survivors and palliative care, meditation, treatment, symptoms and cancer types, postmenopause, cancer pain, low back pain, herbal medicine, children, depression and insomnia, inflammation mediators, and lymphedema. The different research lines are identified according to the main thematic areas, centered fundamentally on anxiety and suffering prevention. The scientific community can use this information to identify where the interest is focused and make decisions in different ways. Research limitation: Several limitations can be addressed: 1) some of the Complementary and Alternative Medicine therapies may not have been included; 2) only the documents indexed in Web of Science are analyzed; and 3) the thematic areas detected could change if another dataset was considered. Practical implications: The results obtained in the present study could be considered as an evidence-based framework in which future studies could be built. Originality/value: Currently, there are no studies that show the thematic evolution of this research area

    Análisis del rendimiento de la paralelización del algoritmo Reed-Solomon

    Get PDF
    Distributed storage systems allow to solve the strong demand of data storage required by today's society, this is because new challenges arise related to data recovery based on erasure code. This article presents the parallelization of the Reed-Solomon algorithm through threads. The evaluation was made in a BLADE system, the execution of the algorithm has been done in a configuration of 1, 2, 4 and 8 threads to check the behavior of the algorithm. Regarding the results, it was observed that the times required for processing the algorithms for both encoding and decoding are considerably reduced.Los sistemas de almacenamiento distribuido permiten resolver la fuerte demanda de almacenamiento de datos que requiere la sociedad actual. Es por ello que surgen nuevos retos relacionados con la recuperación de datos basada en código de borrado. En este artículo se presenta la paralelización del algoritmo Reed-Solomon a través de hilos. La evaluación se ha realizado en un sistema BLADE, la ejecución del algoritmo se ha realizado en una configuración de 1, 2, 4 y 8 hilos para comprobar el comportamiento del algoritmo. En cuanto a los resultados, se observa que se reducen considerablemente los tiempos requeridos para el procesamiento de los algoritmos tanto para codificación como para decodificación

    Explainable Artificial Intelligence (XAI): Concepts, Taxonomies, Opportunities and Challenges toward Responsible AI

    Get PDF
    In the last few years, Artificial Intelligence (AI) has achieved a notable momentum that, if harnessed appropriately, may deliver the best of expectations over many application sectors across the field. For this to occur shortly in Machine Learning, the entire community stands in front of the barrier of explainability, an inherent problem of the latest techniques brought by sub-symbolism (e.g. ensembles or Deep Neural Networks) that were not present in the last hype of AI (namely, expert systems and rule based models). Paradigms underlying this problem fall within the so-called eXplainable AI (XAI) field, which is widely acknowledged as a crucial feature for the practical deployment of AI models. The overview presented in this article examines the existing literature and contributions already done in the field of XAI, including a prospect toward what is yet to be reached. For this purpose we summarize previous efforts made to define explainability in Machine Learning, establishing a novel definition of explainable Machine Learning that covers such prior conceptual propositions with a major focus on the audience for which the explainability is sought. Departing from this definition, we propose and discuss about a taxonomy of recent contributions related to the explainability of different Machine Learning models, including those aimed at explaining Deep Learning methods for which a second dedicated taxonomy is built and examined in detail. This critical literature analysis serves as the motivating background for a series of challenges faced by XAI, such as the interesting crossroads of data fusion and explainability. Our prospects lead toward the concept of Responsible Artificial Intelligence, namely, a methodology for the large-scale implementation of AI methods in real organizations with fairness, model explainability and accountability at its core. Our ultimate goal is to provide newcomers to the field of XAI with a thorough taxonomy that can serve as reference material in order to stimulate future research advances, but also to encourage experts and professionals from other disciplines to embrace the benefits of AI in their activity sectors, without any prior bias for its lack of interpretability

    Electrochemical reduction of CO2 in water-acetonitrile mixtures on nanostructured Cu electrode

    Get PDF
    This communication studies the CO2 reduction reaction in H2O/CH3CN mixtures on nanostructured copper. It was found that the nanostructured copper electrode presents a well-defined voltammogram in acetonitrile, where it can be seen three signals related to adsorbed or surface attached (thin films) species. Also, it was found that the current density of CO2 reduction in mixtures H2O/CH3CN on nanostructured copper electrodes with a mole fraction around 0.25 is higher than those observed with mole fractions lower than 0.15 or higher than 0.35. Finally, nanostructured Cu electrodes show higher catalytic activity towards the CO2 reduction than copper electrode.APSR acknowledges the scholarship “Estudiantes sobresalientes de posgrado” at the “Universidad Nacional de Colombia (UNAL)” and COLCIENCIAS National Doctoral Scholarship (567). MFS acknowledges the support of UNAL (Research Project 19030)

    Three axis vector magnet set-up for cryogenic scanning probe microscopy

    Full text link
    We describe a three axis vector magnet system for cryogenic scanning probe microscopy measurements. We discuss the magnet support system and the power supply, consisting of a compact three way 100 A current source. We obtain tilted magnetic fields in all directions with maximum value of 5T along z-axis and of 1.2T for XY-plane magnetic fields. We describe a scanning tunneling microscopy-spectroscopy (STM-STS) set-up, operating in a dilution refrigerator, which includes a new high voltage ultralow noise piezodrive electronics and discuss the noise level due to vibrations. STM images and STS maps show atomic resolution and the tilted vortex lattice at 150 mK in the superconductor β-Bi2Pd. We observe a strongly elongated hexagonal lattice, which corresponds to the projection of the tilted hexagonal vortex lattice on the surface. We also discuss Magnetic Force Microscopy images in a variable temperature insertThis work was supported by Convocatoria Doctorados en el Exterior 568-2012 COLCIENCIAS, the Spanish MINECO (FIS2011-23488, MAT2011-27470-C02-02, CSD2009-00013), by the Comunidad de Madrid through program Nanofrontmag-CM (S2013/MIT-2850) and by Marie-Curie actions under the project FP7-PEOPLE-2013- CIG-618321. The research leading to these results has received funding from the European Union Seventh Framework Programme under Grant Agreement No. 604391 Graphene Flagship. We also acknowledge Banco Santander, COST MP1201. J.A. and C.M. acknowledge the FPI (BES- 2012-058600) and Juan de la Cierva (JCI-2011-08815) programs, respectivel
    corecore