A inovação tecnológica e o avanço científico: a química em perspectiva

Some general features about the role of Science and Technology in the modern western civilizations are discussed, emphasizing those related to Chemistry. The discussion is centered on the social regulation of technological and scientific institutions and on the way this regulation takes place in response to social demands. Finally, some new trends are presented about the Brazilian chemistry courses and how the local educational authorities intend to modernize them.

O estado vítreo dentro da perspectiva do curso de graduação em química (físico-química)

We consider the relevance of the study of the glassy state properties and the glass transition as important topics of the physical chemistry for undergraduate courses of Chemistry. Two of the most important theoretical approaches for the description of the glassy state, the thermodynamic and the kinetic models, are summarized with emphasis on the physical chemistry aspects. Examples illustrating the glass transition of some materials are also presented.

Cálculo ab initio de intensidades Raman dinâmicas utilizando a teoria da resposta linear

In this paper a methodology for the computation of Raman scattering cross-sections and depolarization ratios within the Placzek Polarizability Theory is described. The polarizability gradients are derived from the values of the dynamic polarizabilities computed at the excitation frequencies using ab initio Linear Response Theory. A sample application of the computational program, at the HF, MP2 and CCSD levels of theory, is presented for H2O and NH3. The results show that high correlated levels of theory are needed to achieve good agreement with experimental data.

Control of permanent magnet linear synchronous motor in motion control applications

The aim of the thesis is to study the principles of the permanent magnet linear synchronous motor (PMLSM) and to develop a simulator model of direct force controlled PMLSM. The basic motor model is described by the traditional two-axis equations. The end effects, cogging force and friction model are also included into the final motor model. Direct thrust force control of PMLSM is described and modelled. The full system model is proven by comparison with the data provided by the motor manufacturer.

El significat de les activitats aquàtiques del nadó des d'una perspectiva evolutiva

Aquest article pretén d’aprofundir des d’una perspectiva evolutiva en l’estudi i l’anàlisi de les activitats aquàtiques del nadó. A partir d’aquí, l’article interpreta des de l’òptica filogenètica i ontogenètica de les activitats aquàtiques dels nadons, quin significat tindran aquestes activitats en el seu desenvolupament general. Per assolir els objectius fixats, l’article utilitza un enfocament fenomenològic (Husserl, 1996) que se sustentarà conceptualment en l’abordatge filogenètic del desenvolupament psicomotriu de Fonseca (1998). Partint d’aquesta estructura, s’estudiaran les raons filogenètiques i ontogenètiques que ens poden significar les activitats aquàtiques del nadó per tal que, en última instància, i des de la línia més existencial de la fenomenologia (Sartre, 1999; Merleau-Ponty, 2000), puguem argumentar la significació evolutiva d’aquestes activitats.

O ensino de química quântica e o computador na perspectiva de projetos

This paper aims to discuss and reflect about the use of computers in the teaching of Quantum Chemistry. A course on Computational Quantum Chemistry concentrating on Medicinal Chemistry projects was developed for undergraduate and graduate students. The results showed that students got more motivated and involved when there is an articulation between theory and practice. This work presents an alternative way to teach Theoretical Chemistry using projects.

Aerossóis atmosféricos: perspectiva histórica, fontes, processos químicos de formação e composição orgânica

This work starts with a historical perspective of the social and scientific progress related to the understanding of the atmospheric aerosol. Its origin, physical, chemical and optical characteristics, as well as its environmental behaviour are described, retracing the evolution of the concepts related to this subject over the last centuries. The main sources that contribute to atmospheric particulate matter and the modern understanding of its formation processes and constitution, focusing on the chemical pathways leading to it and on its organic components are presented. This discussion is complemented with recent evaluations of the quantities emitted by primary, secondary, biogenic and anthropogenic sources and the effects due to accumulation or dispersion of aerosols, justifying the chemical and environmental interest they engender.

Alquilbenzeno sulfonato linear: uma abordagem ambiental e analítica

The environmental impact of detergents and other consumer products is behind the continued interest in the chemistry of the surfactants used. Of these, linear alkylbenzene sulfonates (LASs) are most widely employed in detergent formulations. The precursors to LASs are linear alkylbenzenes (LABs). There is also interest in the chemistry of these hydrocarbons, because they are usually present in commercial LASs (due to incomplete sulfonation), or form as one of their degradation products. Additionally, they may be employed as molecular tracers of domestic waste in the aquatic environment. The following aspects are covered in the present review: The chemistry of surfactants, in particular LAS; environmental impact of the production of LAS; environmental and toxicological effects of LAS; mechanisms of removal of LAS in the environment, and methods for monitoring LAS and LAB, the latter in domestic wastes. Classical and novel analytical methods employed for the determination of LAS and LAB are discussed in detail, and a brief comment on detergents in Brazil is given.

Una perspectiva constructivista de la cognición: Implicaciones para las terapias cognitivas

Desde la epistemología constructivista se considera la cognición como la actividad básica del vivir: interpretar la experiencia, otorgar significado al flujo de los acontecimientos. Por tanto, no se la ve como una actividad intelectual, racional o mental sino holística porque implica al sujeto en su totalidad; aunque se pueda manifestar en forma de pensamientos, emociones, imágenes, etc. Las distintas terapias cognitivas de inspiración constructivista comparten la visión de la persona como un agente que construye de forma proactiva los acontecimientos, incorporando los significados generados en un sistema cuyo núcleo es el sentido de identidad. Los esfuerzos para promover el cambio pueden provocar resistencias a menos que se armonicen con la necesidad esencial de la persona de proteger su sentido de identidad, continuidad y, en consecuencia, su unicidad.

Hacia una mayor incorporación de la perspectiva del paciente en el diseño de los instrumentos de evaluación de la efectividad y calidad de los cuidados

Sin duda alguna, nadie está mejor situado que el paciente mismo a la hora de aprehender su propio punto de vista sobre la experiencia y el resultado de unos cuidados o unas intervenciones. Por ello solo mirando a través de los ojos del paciente veremos cómo mejorar los cuidados que dispensamos. Posibilitar unos cuidados realmente centrados en el paciente requiere una evaluación de dichos cuidados igualmente centrada en el paciente. Dicha evaluación únicamente será posible si, entre otros requisitos como el de la firmeza psicométrica, se considera el grado de incorporación de la perspectiva de los pacientes en el instrumento antes de seleccionar alguno entre los disponibles, o se estima previamente el grado de sensibilidad hacia dicha perspectiva en el caso de que únicamente existan cuestionarios desarrollados sin la participación directa de los pacientes. Asimismo, si el objetivo de alguna de vuestras investigaciones futuras fuera desarrollar un nuevo instrumento de medida, dicho grado de incorporación de la perspectiva del paciente es un aspecto primordial a considerar y fortalecer.

Perspectiva dels estudiants respecte a l'adaptacio de l'assignatura"Dissenys experimentals i aplicats" a l'Espai Europeu d'Educacio Superior.

En este artículo se describe la adaptación de la asignatura"Diseños experimentales y aplicados" de la Facultad de Psicología de la Universitat de Barcelona (UB) según las directrices de esta Universidad para adaptarse al Espacio Europeo de Educación Superior (EEES). Se realizó una investigación con el objetivo de conocer la opinión de los estudiantes respecto a la innovación docente desarrollada a través de la introducción del campus virtual. Para ello, se administró a 180 estudiantes una adaptación del cuestionario EMID (Evaluación del Modelo de Innovación Docente) que valoraba diversos aspectos: las actividades autónomas, el sistema de evaluación continuada y el campus virtual con Moodle. Los resultados del estudio muestran que los estudiantes valoran positivamente dichos aspectos, especialmente el sistema metodológico de enseñanza-aprendizaje-evaluación mediante el campus virtual, así como los materiales teórico-prácticos diseñados para que puedan adquirir las competencias metodológicas de esta asignatura.

Utilização do índice de retenção linear para caracterização de compostos voláteis em café solúvel utilizando GC-MS e coluna HP-Innowax

Gas chromatography coupled with mass spectrometry (GC-MS) is widely used for the characterization of volatile compounds. However, due to the complexity of the soluble coffee matrix, a complete identification of the components should not be based on mass spectra interpretation only. The linear index of retention (LRI) is frequently used to give support to mass spectra. The aim of this work is to investigate the characterization of the volatile compounds in soluble coffee samples by GC-MS using LRI values found with a HP-INNOWAX column. The method used allows a significant increase of the reliability of identifying compounds.

Uma perspectiva computacional sobre catálise enzimática

Enzymes are extremely efficient catalysts. Here, part of the mechanisms proposed to explain this catalytic power will be compared to quantitative experimental results and computer simulations. Influence of the enzymatic environment over species along the reaction coordinate will be analysed. Concepts of transition state stabilisation and reactant destabilisation will be confronted. Divided site model and near-attack conformation hypotheses will also be discussed. Molecular interactions such as covalent catalysis, general acid-base catalysis, electrostatics, entropic effects, steric hindrance, quantum and dynamical effects will also be analysed as sources of catalysis. Reaction mechanisms, in particular that catalysed by protein tyrosine phosphatases, illustrate the concepts.

Análisis de una propuesta de trabajo desde la perspectiva del modelo de convergencia europea

The work presented here describes a part of the experience carried out during the last two academic years in a course called New Technologies Applied to Education within the Teacher Training Studies of the Faculty of Education Sciences and Psychology of the University of Girona. It is a project that involves students working on a proposal closely related to their future professional lives. In it they simulate their intervention in a school staff meeting at which the introduction of ICT into the curriculum is being discussed. This proposal is presented in a WebQuest format. Various individual and group tasks allow the students to acquire knowledge about educational programmes and resources available on the web and to discuss their possible teaching applications in the context of a specific school situation, leading to an analysis of the curricular implications associated with the educational use of the ICT from the teacher’s perspective. During the last two academic years assessments by both the students and the teaching staff have been gathered in order to redesign the proposal and calculate the time necessary for the development of each task following the ECTS system. This proposal, although formulated within the context of current degree programmes, implies a way of working guided by the plans of European convergence (ECTS). In the future it is hoped to establish an interdisciplinary proposal focusing on various subjects of the degree leading to the development of some of the capabilities established in our university’s degree courses in Early Childhood and Primary Teacher Training following the plans of European convergence (ECTS)