A linear filter to reconstruct the ISW effect from CMB and LSS observations

The extraction of a signal from some observational data sets that contain different contaminant emissions, often at a greater level than the signal itself, is a common problem in Astrophysics and Cosmology. The signal can be recovered, for instance, using a simple Wiener filter. However, in certain cases, additional information may also be available, such as a second observation which correlates to a certain level with the sought signal. In order to improve the quality of the reconstruction, it would be useful to include as well this additional information. Under these circumstances, we have constructed a linear filter, the linear covariance-based filter, that extracts the signal from the data but takes also into account the correlation with the second observation. To illustrate the performance of the method, we present a simple application to reconstruct the so-called Integrated Sachs-Wolfe effect from simulated observations of the Cosmic Microwave Background and of catalogues of galaxies.Comment: 8 pages, 6 figures, accepted for publication in the IEEE Journal of Selected Topics in Signal Processin

Minimal mechanisms for vegetation patterns in semiarid regions

The minimal ecological requirements for formation of regular vegetation patterns in semiarid systems have been recently questioned. Against the general belief that a combination of facilitative and competitive interactions is necessary, recent theoretical studies suggest that, under broad conditions, nonlocal competition among plants alone may induce patterns. In this paper, we review results along this line, presenting a series of models that yield spatial patterns when finite-range competition is the only driving force. A preliminary derivation of this type of model from a more detailed one that considers water-biomass dynamics is also presented. Keywords: Vegetation patterns, nonlocal interactionsComment: 8 pages, 4 figure

Novel integrated mechanical biological chemical treatment (MBCT) systems for the production of levulinic acid from fraction of municipal solid waste: A comprehensive techno-economic analysis.

This paper, for the first time, reports integrated conceptual MBCT/biorefinery systems for unlocking the value of organics in municipal solid waste (MSW) through the production of levulinic acid (LA by 5wt%) that increases the economic margin by 110-150%. After mechanical separation recovering recyclables, metals (iron, aluminium, copper) and refuse derived fuel (RDF), lignocelluloses from remaining MSW are extracted by supercritical-water for chemical valorisation, comprising hydrolysis in 2wt% dilute H2SO4 catalyst producing LA, furfural, formic acid (FA), via C5/C6 sugar extraction, in plug flow (210−230°C, 25bar, 12s) and continuous stirred tank (195−215°C, 14bar, 20mins) reactors; char separation and LA extraction/purification by methyl isobutyl ketone solvent; acid/solvent and by-product recovery. The by-product and pulping effluents are anaerobically digested into biogas and fertiliser. Produced biogas(6.4MWh/t), RDF(5.4MWh/t), char(4.5MWh/t) are combusted, heat recovered into steam generation in boiler (efficiency:80%); on-site heat/steam demand is met; balance of steam is expanded into electricity in steam turbines (efficiency:35%)

Density functional theory study of the zeolite-mediated tautomerization of phenol and catechol

Because the structure of lignin consists mostly of inter-linked phenolic monomers, its conversion into more valuable chemicals may benefit from isomerization processes that alter the electronic structure of the aromatic rings. The tautomerization of phenolic-type compounds changes the hybridization from sp2 to sp3 of the carbon atom at the ortho position, which disables the aromaticity and facilitates the subsequent hydrogenation process. Here, we have performed a Density Functional Theory study of the tautomerization of phenol and catechol at the external surface of zeolite MFI. The tautomerization starts with the adsorption of the molecule on three-coordinated Lewis acid sites, followed by the dissociation of the phenolic hydroxyl group, with the transfer of the proton to the zeolite framework. The rotation of the deprotonated molecule enables a more favourable orientation for the back-transfer of the proton to the carbon atom at the ortho position. The energy barriers of the process are smaller than 55 kJ/mol, suggesting that this transformation is easily accessible under standard reaction conditions

DFT modeling of the adsorption of trimethylphosphine oxide at the internal and external surfaces of zeolite MFI

The characterization of the acidity of zeolites allows a direct correlation with their catalytic activity. To this end, probe molecules are utilized to obtain a ranking of acid strengths. Trimethylphosphine oxide (TMPO) is a widely used probe molecule, which allows the sensing of solid acids by using 31P NMR. We have performed calculations based on the density functional theory to investigate the Brønsted acid (BA) sites in zeolite MFI by adsorbing TMPO as a probe molecule. We have considered the substitution of silicon at the T2 site by aluminum, both at the internal cavity and at the external surface. The different acid strengths observed in the zeolite MFI when probed by TMPO (very strong, strong, and weak) may depend on the basicity of the centers sharing the acid proton. If the proton lies between the TMPO and one of the framework oxygen atoms binding the Al, the acidity is strong. When the framework oxygen atom is not directly binding the Al, it is less basic and a shortening of the TMPO–H distance is observed, causing an acid response of very strong. Finally, if two TMPO molecules share the proton, the TMPO–H distance elongates, rendering a weak acid character

Effect of phytoremediated port sediment as an agricultural medium for pomegranate cultivation: Mobility of contaminants in the plant

Although the dredging of ports is a necessary management activity, it generates immense quantities of sediments, that are defined by the European Union as residues. On the other hand, the relevant peat demand for plant cultivation compromises its availability worldwide. In this context, the present work wanted to find an alternative substrate in order to replace and/or reduce the use of peat in agriculture, through the study of the suitability, concerning the exchange of substrate–plant–water pollutants, of the dredged remediated sediments as a fruit-growing media. Forty-five pomegranate trees (Punica granatum L. cv “Purple Queen”) were cultivated in three types of substrates (100% peat as a control, 100% dredged remediated sediments and 50% both mixed). The metal ion content and pesticide residues were analysed in the different plant parts (root, stem, leaves and fruits) and in drainage water. The results showed a limited transfer of pollutants. All the pollutants were below the legal limits, confirming that the dredged sediments could be used as a growing media, alone or mixed with other substrates. Thus, the results point out the need to open a European debate on the reuse and reconsideration of this residue from a circular economy point of view

A density functional theory study of the structure of pure-silica and aluminium-substituted MFI nanosheets

The layered MFI zeolite allows a straightforward hierarchization of the pore system which accelerates mass transfer and increases its lifetime as a catalyst. Here, we present a theoretical study of the structural features of the pure-silica and aluminium-substituted MFI nanosheets. We have analysed the effects of aluminium substitution on the vibrational properties of silanols as well as the features of protons as counter-ions. The formation of the two-dimensional system did not lead to appreciable distortions within the framework. Moreover, the effects on the structure due to the aluminium dopants were the same in both the bulk and the slab. The principal differences were related to the silanol groups that form hydrogen-bonds with neighbouring aluminium-substituted silanols, whereas intra-framework hydrogen-bonds increase the stability of aluminium-substituted silanols toward dehydration. Thus, we have complemented previous experimental and theoretical studies, showing the lamellar MFI zeolite to be a very stable material of high crystallinity regardless of its very thin structure

Microstructure Architecture Development in Metals and Alloys By Additive Manufacturing Using Electron Beam Melting

The concept of materials with controlled microstructural architecture (MCMA) to develop and fabricate structural materials with novel and possibly superior properties and performance characteristics is a new paradigm or paradigm extension for materials science and engineering. In the conventional materials science and engineering paradigm, structure (microstructure), properties, processing, and performance features are linked in the development of desirable materials properties and performance through processing methodologies which manipulate microstructures. For many metal or alloy systems, thermomechanical treatment combining controlled amounts of plastic deformation with heat treatment or aging cycles can achieve improved mechanical properties beyond those attainable by conventional processing alone (such as rolling or forging for example) through controlled microstructure development. In this paper we illustrate a new concept involving the fabrication of microstructural architectures by the process development and selective manipulation of these microstructures ideally defining material design space. This allows for the additional or independent manipulation of material properties by additive manufacturing (AM) using electron beam melting (EBM). Specifically we demonstrate the novel development of a carbide (M23C6) architecture in the AM of a Co-base alloy and an oxide (Cu2O) precipitate-dislocation architecture in the AM of an oxygen-containing Cu. While more conventional processing can produce various precipitate microstructures in these materials, EBM produces spatial arrays of precipitate columns or columnar-like features often oriented in the build direction. These microstructural architectures are observed by optical microscopy and scanning and transmission electron microscopy. Prospects for EBM architecture development in precipitation-hardenable Al alloys is also discussed. In the EBM build process using precursor powders, the electron beam parameters (including beam focus, scan speed and sequencing) produce localized, requisite thermodynamic regimes which create or organize the precipitate-related spatial arrays. This feature demonstrates the utility of AM not only in the fabrication of complex components, but also prospects for selective property design using CAD for MCMA development: a new or extended processing-microstructure-property-performance paradigm for materials science and engineering in advanced manufacturing involving solid free-form fabrication (SFF).Mechanical Engineerin

Effect of Build Parameters and Build Geometries on Residual Microstructures and Mechanical Properties of Ti-6Al-4V Components Built by Electron Beam Melting (EBM)

In this study, involving additive manufacturing (AM) using electron beam melting (EBM), we have examined build defects which result from beam tripping, porosities (including unmelted or unsintered zones) due to excursions from optimal build parameters (especially variations in melt scan beam current and scan speed), and gas bubbles trapped in atomized Ti-6Al-4V starting powder as well as recycled powder, and retained in the build. At optimized build conditions we have also examined microstructure-mechanical property (hardness, tensile strength, and elongation) variations for multiple rake building and multiple melt scans using optical metallography and scanning and transmission electron microscopy (SEM and TEM). These build variances cause cooling rate variances which promote α-phase growth and variations in dislocation density, as well as α-to-α' (martensite) phase changes, all of which produce some degree of mechanical property variations. These features (especially α-to-α' phase changes) are notable on comparing solid builds in comparison with a variety of mesh arrays where strut dimension and build-element complexities alter the cooling rates in a significant way. We illustrate these microstructure variations with corresponding variations in microindentation hardness measurements made directly on fine mesh (strut) structures. Finally, we have examined Ti-6Al-4V powder chemistries and solid build chemistries which for single-pass melt scans at optimized build conditions are shown to be relatively constant up to 40 cycles of powder reuse with the exception of Al content which was reduced by 10 to 15% in solid builds at optimized conditions. However, Al loss in solid builds approached 25% for multiple (2 and 3) melt scans, while no changes in Ar gas-bubble density were observed with changes in α-phase (grain) width which increased from 3 µm for a single melt scan to 4.5 and 6 µm for 2 and 3 melt scans, respectively. Corresponding Rockwell C-scale (HRC) hardness varied from 37, 36, and 35, respectively; with ultimate tensile strengths exceeding 1.2 GPa at elongations of 12% or higher for this melt scan sequence.Mechanical Engineerin