DFT study of the CO oxidation on the Au(321) surface

The CO oxidation on the Au(321) surface was investigated using spin polarized density functional theory based calculations within the GGA-PW91 exchange-correlation functional. This was done by studying separately the adsorption of isolated CO or CO2 and also the coadsorption of CO + O or CO + O-2 on the Au(321) surface. A periodic supercell approach was used to model the gold surface. The kinetic profile of the oxidation reaction was determined with the climbing image-nudged elastic band method and also with the dimer approach. It was found that CO adsorbs on the clean surface preferably at the kinks, and the same preference exists if atomic or molecular oxygen is coadsorbed on the Au(321) surface. CO2 is weakly adsorbed on Au(321) and appears at large distance from the metal surface. Importantly, the formation of carbonate species or of four atoms compounds, OCOO, adsorbed on the Au(321) surface is thermodynamically favorable from CO and O-2. The reaction of CO oxidation by atomic oxygen occurs almost without any energy cost on a reconstructed surface, whereas moderate barriers of similar to 0.6 eV were computed for the direct reaction with molecular oxygen occurring at the surface steps. These results suggest that the predissociation of the molecular oxygen on the Au(321) surface for the CO oxidation is energetically less favorable than the direct reaction with molecular oxygen. Finally, the products of the oxidation reaction are much more stable than the four atoms compound.publishe

Industrial Automation Self-Learning Through the Develoment of Didactic Industrial Processes

Trabalho apresentado no 20th International Conference on Interactive Collaborative Learning, 27-29 de setembro 2017, Budapeste, HungriaTeaching industrial automation is a complex mission. The classical approach is based on lectures and laboratories assisted by teachers. Nevertheless, teaching industrial automation using the classical approach is not easy because this multidisciplinary area requires knowledge in control, energy, electronics, robotics and computer engineering, among others. In this way, this paper presents an approach to teach Industrial Automation based on a self learning strategy. Instead of using the classical approach, students must develop a research work and a didactic automation prototype. The results of this methodology indicate that students increase the interest about industrial automation and clarify important aspects of assembly, commissioning, parameterization and programming of electric and electronic devices. Additionally this methodology seems to increase self-confidence of students and give them the necessary background to face the challenge of working in the real world.N/

Epidemiologia e controle da esquistossomose mansônica em área onde o hospedeiro intermediário é Biomphalaria tenagophila

The epidemiology and control of schistosomiasis mansoni in the Municipality of Pedro de Toledo (State of S. Paulo, Brazil) since 1980, has been studied. In 1980 the prevalence evaluated by stool exams (Kato-Katz method) was 22.8% and no statistical difference at 5.0% level was observed between rural and urban zones. The intensity of infection was low (58.5 eggs/g of faeces); the highest prevalence and intensity of infection rates were observed within the group of from 5 to 29 years of age, respectively. The transmission of schistosomiasis usually occurred during leisure time. The majority of the carriers of the parasite were asymptomatic. Of the B. tenagophila examined only 0.4% were found to be infected. The control programme has been intensified from 1981 on resulting in a sharp decrease in the prevalence from 22.8% in 1980 to 6% at the present time. This result shows that, in spite of the control programme there is a residual human prevalence. A beginning has been made on the investigation into the possible causes of this residual prevalence (6.0% was maintained through out 1987).Desde 1980, está-se estudando a epidemiologia e o controle da esquistossomose mansônica no Município de Pedro de Toledo (Estado de São Paulo, Brasil). Em 1980 a prevalência avaliada por exame de fezes (método de Kato-Katz) foi de 22,8%. Estatisticamente, ao nível de 5%, não houve diferença nas prêvalencias observadas nas zonas rural e urbana. A intensidade de infecção foi baixa (média geométrica de 58,5 ovos por grama de fezes). As maiores prevalências e intensidades de infecção foram registradas na faixa etária de 5 a 29 anos. Geralmente a transmissão da endemia verificou-se durante o lazer. Apenas 0,4% de B. tenagophila mostraram-se positivos para cercárias de S. mansoni. A maioria dos portadores era assintomático. O programa de controle foi intensificado após avaliação dos dados de 1980, resultando em diminuição acentuada da prevalência de 22,8% em 1980 para 6%. Esta prevalência residual vem se mantendo até 1987. Agora iniciamos estudos para investigar as possíveis causas dessa prevalência residual

Conversando sobre Património Industrial e outras Histórias: palavras, espaços e imagens

O conjunto de entrevistas apresentadas neste livro procura dar uma nova visão acerca do património industrial. Com uma abordagem aos estudos e às trajectórias de diversos estudiosos do Brasil e de Portugal, aos percursos de formação de cada autor (a), às suas várias temporalidades e vinculações institucionais distintas, a obra valoriza as narrativas orais de quem viveu o processo de construção e consolidação dessa área de pesquisa nos dois países. O objectivo é contribuir para o debate complexo e contínuo sobre o património e possibilita uma ampliação do nosso entendimento dos modos como esta área se firmou e se vem afirmando em diversos espaços, dentro e fora das universidades