Search results for "functional"

Periodismo especializado y especialización política

2015

En este artículo se revisa la bibliografía sobre periodismo especializado y se analizan los rasgos normalmente aducidos para identificar la especialización periodística, que apuntan por lo general al contenido de los textos: la especificidad temática, el enfoque en profundidad, la metodología de investigación, el recurso a fuentes expertas, la necesidad de formación complementaria a la pro-piamente periodística, la orientación a audiencias segmentadas, el uso de géneros textuales con-cretos, o la adecuación lingüística. La aplicación de estos mismos factores a la especialización políti-ca pone de manifiesto la necesidad de cuestionar los rasgos aducidos y considerar otros criterios en el co…

Observed Fitness May Affect Niche Overlap in Competing Species via Selective Social Information Use

2013

Social information transmission is important because it enables horizontal spread of behaviors, not only between conspecifics but also between individuals of different species. Because interspecific social information use is expected to take place among species with similar resource needs, it may have major consequences for the emergence of local adaptations, resource sharing, and community organization. Social information use is expected to be selective, but the conditions promoting it in an interspecific context are not well known. Here, we experimentally test whether pied flycatchers (Ficedula hypoleuca) use the clutch size of great tits (Parus major) in determining the quality of the ob…

Gallium preference for the occupation of tetrahedral sites in Lu3(Al5-xGax)O12multicomponent garnet scintillators according to solid-state nuclear ma…

2019

Abstract In this study, the distributions of aluminum and gallium atoms over the tetrahedral and octahedral sites in the garnet structure were investigated in mixed Lu3Al5-xGaxO12 crystals by using 27Al and 71Ga magic angle spinning nuclear magnetic resonance (NMR) and single crystal 71Ga NMR. The experimental study was supported by theoretical calculations based on density functional theory (DFT) in order to predict the trends in terms of the substitutions of Al by Ga in the mixed garnets. Both the experimental and theoretical results indicated the non-uniform distribution of Al and Ga over the tetrahedral and octahedral sites in the garnet structure, with a strong preference for Ga occupy…

A Theoretical and Experimental Investigation of the Spectroscopic Properties of a DNA-Intercalator Salphen-Type ZnIIComplex

2014

The photophysical and DNA-binding properties of the cationic zinc(II) complex of 5-triethylammonium methyl salicylidene ortho-phenylenediiminato (ZnL 2 + ) were investi- gated by a combination of experimental and theoretical methods. DFT calculations were performed on both the ground and the first excited states of ZnL 2 + and on its possi- ble mono- and dioxidation products, both in vacuo and in selected solvents mimicked by the polarizable continuum model. Comparison of the calculated absorption and fluores- cence transitions with the corresponding experimental data led to the conclusion that visible light induces a two-elec- tron photooxidation process located on the phenylenediimi- nato…

Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems

2020

Over the last few years, extraordinary advances in experimental and theoretical tools have allowed us to monitor and control matter at short time and atomic scales with a high degree of precision. An appealing and challenging route toward engineering materials with tailored properties is to find ways to design or selectively manipulate materials, especially at the quantum level. To this end, having a state-of-the-art ab initio computer simulation tool that enables a reliable and accurate simulation of light-induced changes in the physical and chemical properties of complex systems is of utmost importance. The first principles real-space-based Octopus project was born with that idea in mind,…

Spin caloric transport from density-functional theory

2019

Spin caloric transport refers to the coupling of heat with spin transport. Its applications primarily concern the generation of spin currents and control of magnetisation by temperature gradients for information technology, known by the synonym spin caloritronics. Within the framework of ab initio theory, new tools are being developed to provide an additional understanding of these phenomena in realistic materials, accounting for the complexity of the electronic structure without adjustable parameters. Here, we review this progress, summarising the principles of the density-functional-based approaches in the field and presenting a number of application highlights. Our discussion includes th…

An Examination of Tourist Arrivals Dynamics Using Short-Term Time Series Data: A Space—Time Cluster Approach

2013

The purpose of this study is to examine the development of Italian tourist areas ( circoscrizioni turistiche) through a cluster analysis of short time series. The technique is an adaptation of the functional data analysis approach developed by Abraham et al (2003), which combines spline interpolation with k-means clustering. The findings indicate the presence of two patterns (increasing and stable) averagely characterizing groups of territories. Moreover, tests of spatial contiguity suggest the presence of ‘space–time clusters’; that is, areas in the same ‘time cluster’ are also spatially contiguous. These findings appear to be more robust in particular for those series characterized by an…

Multi-functional Stabilizers-functionalized Carbon Nanotubes for advanced Ultra-High Molecular Weight Polyethylene-based Nanocomposites

2015

Stabilizing molecules, such as hindered phenols (both synthetic and naturally occurring), polyphenols and hindered amine light stabilizers, were covalently linked or physically absorbed onto outer surface of multi-walled carbon nanotubes (CNTs) and the obtained multi-functional fillers (Stab-f-CNTs) were dispersed in Ultra High Molecular Weight Polyethylene (UHMWPE) aiming at obtaining advanced nanocomposites with enhanced thermo- and/or photo-oxidative stability, electrical and mechanical properties. The chemical grafting or physical absorption of stabilizing molecules is confirmed by spectroscopic, spectrometric and thermo-gravimetric analyses, and the influence of the multi-functional na…

Real-space quantum transport in two-dimensional nanostructures in magnetic fields

2013

A case formulation model for the assessment of psychological problems among deafblind persons

2012

In order to describe and understand possible problems associated with deafblindness we applied a functional analysis case formulation strategy and Functional Analytic Clinical Case Diagrams (FACCD). We collected clinical assessment data from deafblind persons who were experiencing multiple psychological problems as reported by their healthcare professionals. The data were collected after the healthcare professionals were trained in functional analyses and in applying FACCD. The 21 deafblind persons assessed by healthcare professionals were reported to have 3–11 psychological problems. Two case examples are given to illustrate the complexity of a deafblind person's life situation and the fun…