Role of crystal size on swing-effect and adsorption induced structure transition of ZIF-8.

The flexibility and structure transition behaviour of ZIF-8 in a series of samples with different particle size has been studied using a combination of high-resolution N2 gas adsorption isotherms and, for the first time, a broad in situ PXRD and Rietveld analysis. During the stepped adsorption process, large particles showed a narrow adsorption/desorption pressure range with a shorter equilibrium time due to lower kinetic hindrance, deriving from higher amount of active sites. In situ PXRD showed that both the rotation of imidazole ring and a bend in the methyl group led to the gate opening of ZIF-8.This work was funded by the EPSRC IAA Partnership Development Award (RG/75759). D.F.-J. thanks the Royal Society for funding through a University Research Fellowship. We thank Diamond Light Source for beamtime at beamline I11 (visit EE9750).This is the author accepted manuscript. The final version is available from the Royal Society of Chemistry via http://dx.doi.org/10.1039/C6DT00565

Multiple target task sharing support for the OpenMP accelerator model

The use of GPU accelerators is becoming common in HPC platforms due to the their effective performance and energy efficiency. In addition, new generations of multicore processors are being designed with wider vector units and/or larger hardware thread counts, also contributing to the peak performance of the whole system. Although current directive–based paradigms, such as OpenMP or OpenACC, support both accelerators and multicore-based hosts, they do not provide an effective and efficient way to concurrently use them, usually resulting in accelerated programs in which the potential computational performance of the host is not exploited. In this paper we propose an extension to the OpenMP 4.5 directive-based programming model to support the specification and execution of multiple instances of task regions on different devices (i.e. accelerators in conjunction with the vector and heavily multithreaded capabilities in multicore processors). The compiler is responsible for the generation of device-specific code for each device kind, delegating to the runtime system the dynamic schedule of the tasks to the available devices. The new proposed clause conveys useful insight to guide the scheduler while keeping a clean, abstract and machine independent programmer interface. The potential of the proposal is analyzed in a prototype implementation in the OmpSs compiler and runtime infrastructure. Performance evaluation is done using three kernels (N-Body, tiled matrix multiply and Stream) on different GPU-capable systems based on ARM, Intel x86 and IBM Power8. From the evaluation we observe speed–ups in the 8–20% range compared to versions in which only the GPU is used, reaching 96 % of the additional peak performance thanks to the reduction of data transfers and the benefits introduced by the OmpSs NUMA-aware scheduler.This work is partially supported by the IBM/BSC Deep Learning Center Initiative, by the Spanish Government through Programa Severo Ochoa (SEV-2015-0493), by the Spanish Ministry of Science and Technology through TIN2015-65316-P project and by the Generalitat de Catalunya (contract 2014-SGR-1051).Peer ReviewedPostprint (author's final draft

Life table analysis of Diaphorina citri (Hemiptera: Psyllidae) infesting sweet orange (Citrus sinensis) in São Paulo

An ecological life table for eggs and nymphs of Diaphorina citri Kuwayama (Hemiptera: Psyllidae) was constructed with data obtained from orange orchards (Citrus sinensis Osbeck) in 2 regions of the State of São Paulo, over 4 generations in the period from XI-2006 to V-2007, comprising spring, summer, and fall seasons. Young growing shoots with D. citri eggs present were identifed, and live individuals were counted until adult emergence. No predatory arthropods were observed in association with D. citri eggs and nymphs during the study. The mean parasitism of fourth- and ffth-instar nymphs by Tamarixia radiata Waterston (Hymenoptera: Eulophidae) was 2.3%. The durations of the egg–adult period were similar among the 4 generations, ranging from 18.0 to 24.7 d (at mean temperatures ranging from 21.6 to 26.0 °C) and followed the temperature requirement models obtained in the laboratory for D. citri. However, survival from the egg to the adult stage for the same period varied considerably from 1.7 to 21.4%; the highest mortalities were observed in the egg and small nymphal (frst- to thirdinstar) stages, which were considered to be key phases for population growth of the pest.Uma tabela de vida ecológica foi construída para ovos e ninfas de Diaphorina citri Kuwayama (Hemiptera: Psyllidae) com dados obtidos em pomares de laranja (Citrus sinensis Osbeck) em 2 regiões do estado de São Paulo, com 4 gerações, no período de novembro de 2006 a maio de 2007, compreendendo as estações de primavera, verão e outono. Ramos jovens em crescimento com a presença de ovos de D. citri foram identificados e os indivíduos vivos foram contados até a emergência dos adultos. Nenhum predador foi observado associado a ovos e ninfas de D. citri durante o estudo. A taxa média de parasitismo de ninfas de quarto e quinto ínstares por Tamarixia radiata Waterson (Hymenoptera: Eulophidae) foi de 2.3%. A duração do período de ovo a adulto foi semelhante entre as quatro gerações, variando de 18.0 a 24.7 dias (com temperaturas médias de 21.6 a 26.0 °C) e seguiram os modelos de exigencias térmicas obtidas em laboratório para D. citri. Todavia, a sobrevivencia de ovo até o estágio adulto variou consideravelmente para o mesmo período, de 1.7 a 21.4%, sendo que as maiores mortalidades foram observadas nos estágios de ovos e ninfas pequenas (de primeiro a terceiro ínstares), as quais foram consideradas fases chaves para o crescimento populacional desta praga.info:eu-repo/semantics/publishedVersio

Thermal requirements and estimation of number of generations per year of sugarcane borer in four localities of the state of São Paulo, Brazil

Estudou-se a biologia da broca-da-cana-de-açúcar (Diatraea saccharalis Fabricius, 1794) (Lepidoptera-Pyralidae), em dieta artificial, em cinco temperaturas constantes (20, 22, 25, 30 e 32°C) visando determinar as exigências térmicas das diferentes fases de desenvolvimento do inseto. As constantes térmicas para as fases de ovo, lagarta, pupa e adulto foram, respectivamente: 67,47; 516,96; 126,08 e 172,02 graus-dias (GD), sendo as temperaturas-bases das quatro fases (ovo, lagarta, pupa e adulto) 11,2; 7,3; 10,6 e 7,1°C. Com base nas exigências térmicas das diferentes fases biológicas do inseto, estimou-se que a praga pode apresentar cinco gerações anuais completas nas localidades de Piracicaba, Ribeirão Preto, Jaú e Pindorama, no Estado de São Paulo. The biology of sugarcane borer (Diatraea saccharalis Fabricius, 1794) (Lepidoptera: Pyralidae) was studied in the laboratory on an artificial diet and under five constant temperatures (20, 22, 25, 30 and 32°C) with the objective to determine the thermal requirements of the development stages of the insect. The thermal requirements for the egg, larval, pupal and adult phases were, respectively, 67.47; 516.96; 126.08 and 172.02 degree-days (DG) while the threshold temperatures for the four phases were 11.2; 7.3; 10.6 and 7.1°C, calculated by the coeficient of variation method. Based on the thermal requirements of the different insect phases, it was estimated that the pest can complete five generations per year in ten localities of Piracicaba, Ribeirão Preto, Jaú and Pindorama in the state of São Paulo, Brazil.

The role of conductive additives on the performance of hybrid carbon xerogels as electrodes in aqueous supercapacitors

Three different hybrid carbon xerogels containing Graphene Oxide (AXGO), Micronized Graphite (AXMG) and Carbon Black (AXCB) were synthesized using an easy, fast and affordable method. These three additives were initially selected to improve the electrical conductivity of the pristine activated carbon xerogel (AX) thus expecting to improve its performance in aqueous supercapacitors. Capacitances of the corresponding devices were measured as a function of current density and results of the high and low charge transfer regime of the supercapacitors were discussed separately. In both regimes, the differences observed between the hybrid electrodes were analyzed on the basis of the concurrent influence of the micro and mesoporosity, surface chemistry and electrical conductivity of the materials. Accordingly, even though all the hybrid carbon xerogels showed higher electrical conductivities, only AXGO rendered a better performance than AX, showing the highest capacitances in the whole interval of intensities studied. Consequently, at 16 A g−1, the energy and power densities of the AXGO supercapacitors increased up to 16% and 97%, respectively, with respect to AX, and of 143% and 409%, respectively, with respect to a commercial activated carbon used as reference. The performance of AXCB and, especially AXMG was worse than AX supercapacitors due to a combination of inadequate pore size distributions and/or a poor surface chemistry. Finally, TEM analysis helped to understand the different way the three additives were affecting the nanostructure (and final properties) of the hybrid carbon xerogels.Authors gratefully acknowledge the financial support from the Ministerio de Economía, Industria y Competitividad from Spain (Project CTQ2017-87820-R). MCR also acknowledges CSIC (Project I.E. 201880E010)

Adenovirus-36 Seropositivity and Its Relation with Obesity and Metabolic Profile in Children

The human adenovirus 36 (Ad-36) is causally and correlatively associated in animals and humans, respectively, with increased adiposity and altered metabolic profile. In previous studies, the relationship between Ad-36 seropositivity with obesity was established in adults and children. We evaluated the association of positive antibodies to Ad-36 with obesity and metabolic profile in Mexican children. Seventy-five children with normal-weight and 82 with obesity were studied in this research. All children had a clinic assessment which included weight, height, body circumferences, and skinfold thickness. Laboratory analyzes included triglycerides, total cholesterol, high-density lipoprotein, low-density lipoprotein, and glucose and insulin levels. An enzyme-linked immunosorbent assay (ELISA) was used to determine the antibodies to Ad-36 in the serum samples. The overall Ad-36 seroprevalence was 73.9%. Ad-36 seropositivity had a higher prevalence in obese children than in normal weight group (58.6 versus 41.4%, P=0.007). Ad-36 seropositivity was associated with obesity (OR=2.66, P=0.01) and high-density lipoprotein <40 mg/dL (OR=2.85, P=0.03). The Ad-36 seropositive group had greater risk of 4 metabolic abnormalities compared with those children without none alteration. In summary, Ad-36 seropositivity was associated with obesity and low HDL-c levels in the sample of children studied

Electrophoretic mobility of supercoiled, catenated and knotted DNA molecules

We systematically varied conditions of two-dimensional (2D) agarose gel electrophoresis to optimize separation of DNA topoisomers that differ either by the extent of knotting, the extent of catenation or the extent of supercoiling. To this aim we compared electrophoretic behavior of three different families of DNA topoisomers: (i) supercoiled DNA molecules, where supercoiling covered the range extending from covalently closed relaxed up to naturally supercoiled DNA molecules; (ii) postreplicative catenanes with catenation number increasing from 1 to ∼15, where both catenated rings were nicked; (iii) knotted but nicked DNA molecules with a naturally arising spectrum of knots. For better comparison, we studied topoisomer families where each member had the same total molecular mass. For knotted and supercoiled molecules, we analyzed dimeric plasmids whereas catenanes were composed of monomeric forms of the same plasmid. We observed that catenated, knotted and supercoiled families of topoisomers showed different reactions to changes of agarose concentration and voltage during electrophoresis. These differences permitted us to optimize conditions for their separation and shed light on physical characteristics of these different types of DNA topoisomers during electrophoresi

CHARACTERIZATION OF THE DIFFERENT FRACTIONS OBTAINED FROM THE PYROLYSIS OF ROPE INDUSTRY WASTE

Abstract A study of the possibilities of pyrolysis for recovering wastes of the rope&apos;s industry has been carried out. The pyrolysis of this lignocellulosic residue started at 250 ºC, with the main region of decomposition occurring at temperatures between 300 and 350 ºC. As the reaction temperature increased, the yields of pyrolyzed gas and oil increased, yielding 22 wt.% of a carbonaceous residue, 50 wt.% tars and a gas fraction at 800 ºC. The chemical composition and textural characterization of the chars obtained at various temperatures confirmed that even if most decomposition occurs at 400 ºC, there are some pyrolytic reactions still going on above 550 ºC. The different pyrolysis fractions were analyzed by GC-MS; the produced oil was rich in hydrocarbons and alcohols. On the other hand, the gas fraction is mainly composed of CO 2 , CO and CH 4 . Finally, the carbonaceous solid residue (char) displayed porous features, with a more developed porous structure as the pyrolysis temperature increase