Experimental VLE data of methyl acetate or ethyl acetate + 1-butanol at 0.6 MPa. Predictions with Peng-Robinson EOS and group contribution models

Vapor-liquid equilibrium data were obtained with a stainless steel ebulliometer at 0.6 MPa for methyl acetate + 1-butanol and ethyl acetate + 1-butanol. The experimental data for the binary systems were tested and verified thermodynamically, showed positive consistency when the point-to-point test of Van Nesswas applied. The group contribution models ASO Gand three versions of the UNIFAC were applied to calculate the vapor-liquid equilibrium data and after, these values were compared to the experimental data.The approach f-f was applied by using the Peng-Robinson equation of state, the classical attractive term was employed. The quadratic and Wong-Sandler mixing rules were verified and the adjustable parameter of Stryjek-Vera was also applied

A continuum theory for mineral solid solutions undergoing chemo-mechanical processes

Recent studies on metamorphic petrology as well as microstructural observations suggest the influence of mechanical effects upon chemically active metamorphic minerals. Thus, the understanding of such a coupling is crucial to describe the dynamics of geomaterials. In this effort, we derive a thermodynamically-consistent framework to characterize the evolution of chemically active minerals. We model the metamorphic mineral assemblages as a solid-species solution where the species mass transport and chemical reaction drive the stress generation process. The theoretical foundations of the framework rely on modern continuum mechanics, thermodynamics far from equilibrium, and the phase-field model. We treat the mineral solid solution as a continuum body, and following the Larch\'e and Cahn network model, we define displacement and strain fields. Consequently, we obtain a set of coupled chemo-mechanical equations. We use the aforementioned framework to study single minerals as solid solutions during metamorphism. Furthermore, we emphasise the use of the phase-field framework as a promising tool to model complex multi-physics processes in geoscience. Without loss of generality, we use common physical and chemical parameters found in the geoscience literature to portrait a comprehensive view of the underlying physics. Thereby, we carry out 2D and 3D numerical simulations using material parameters for metamorphic minerals to showcase and verify the chemo-mechanical interactions of mineral solid solutions that undergo spinodal decomposition, chemical reactions, and deformation

A continuum theory for mineral solid solutions undergoing chemo-mechanical processes

Recent studies on metamorphic petrology as well as microstructural observations suggest the influence of mechanical effects upon chemically active metamorphic minerals. Thus, the understanding of such a coupling is crucial to describe the dynamics of geomaterials. In this effort, we derive a thermodynamically consistent framework to characterize the evolution of chemically active minerals. We model the metamorphic mineral assemblages as a solid-species solution where the species mass transport and chemical reaction drive the stress generation process. The theoretical foundations of the framework rely on modern continuum mechanics, thermodynamics far from equilibrium, and the phase-field model. We treat the mineral solid solution as a continuum body, and following the Larché and Cahn network model, we define displacement and strain fields. Consequently, we obtain a set of coupled chemo-mechanical equations. We use the aforementioned framework to study single minerals as solid solutions during metamorphism. Furthermore, we emphasise the use of the phase-field framework as a promising tool to model complex multi-physics processes in geoscience. Without loss of generality, we use common physical and chemical parameters found in the geoscience literature to portrait a comprehensive view of the underlying physics. Thereby, we carry out 2D and 3D numerical simulations using material parameters for mineral solid solutions to showcase and verify the chemo-mechanical interactions of mineral solid solutions that undergo spinodal decomposition, chemical reactions, and deformation.journal articl

Idades preliminares U-Pb, ID-TIMS, das Ilhas Berlengas, Portugal = Preliminary ID-TIMS, U-Pb ages of the Berlengas Islands, Portugal

Apresentam-se os resultados provisórios das idades U-Pb de duas amostras das ilhas do grupo das Berlengas. No Farilhão Grande uma amostra de granito de duas micas com silimanite foi recolhida de um complexo metamórfico. Esta amostra ofereceu três fracções de monazite com idade 377+-1 Ma, interpretada como metamórfica, enquanto uma fracção de zircões de concórdia 483 Ma sugeriu uma idade Tremadoc. Esta última fracção é herdada, provavelmente do volumoso magmatismo do Ordovícico Inferior existente na Ibéria. Na Berlenga Grande o granito apresenta fracções de monazite e zircão concordantes de 307,4+-0,8 Ma.

Antibacterial activity of a chitosan-PVA-Ag+-Tobermorite composite for periodontal repair

A polymer-mineral composite was prepared by solvent casting a mixture of chitosan, poly(vinyl alcohol), and Ag+-exchanged tobermorite in dilute acetic acid and characterised by scanning electron microscopy and Fourier transform infrared spectroscopy. The in vitro bioactivity of the CPTAg membrane was confirmed by the formation of hydroxyapatite on its surface in simulated body fluid. The alkaline dissolution products of the tobermorite lattice buffered the acidic breakdown products of the chitosan polymer and the presence of silver ions resulted in marked antimicrobial action against S. aureus, P. aeruginosa, and E. coli. The in vitro cytocompatibility of the CPTAg membrane was confirmed using MG63 osteosarcoma cells. The findings of this preliminary study have indicated that chitosan-poly(vinyl alcohol)-Ag+-tobermorite composites may be suitable materials for guided tissue regeneration applications

Sensory adaptation to chemical cues by vomeronasal sensory neurons

Sensory adaptation is a source of experience-dependent feedback that impacts responses to environmental cues. In the mammalian main olfactory system (MOS), adaptation influences sensory coding at its earliest processing stages. Sensory adaptation in the accessory olfactory system (AOS) remains incompletely explored, leaving many aspects of the phenomenon unclear. We investigated sensory adaptation in vomeronasal sensory neurons (VSNs) using a combination of in situ Ca2+ imaging and electrophysiology. Parallel studies revealed prominent short-term sensory adaptation in VSNs upon repeated stimulation with mouse urine and monomolecular bile acid ligands at interstimulus intervals (ISIs) less than 30 s. In such conditions, Ca2+ signals and spike rates were often reduced by more than 50%, leading to dramatically reduced chemosensory sensitivity. Short-term adaptation was reversible over the course of minutes. Population Ca2+ imaging experiments revealed the presence of a slower form of VSN adaptation that accumulated over dozens of stimulus presentations delivered over tens of minutes. Most VSNs showed strong adaptation, but in a substantial VSN subpopulation adaptation was diminished or absent. Investigation of same-and opposite-sex urine responses in male and female VSNs revealed that adaptation to same-sex cues occurred at ISIs up to 180 s, conditions that did not induce adaptation to opposite-sex cues. This result suggests that VSN sensory adaptation can be modulated by sensory experience. These studies comprehensively establish the presence of VSN sensory adaptation and provide a foundation for future inquiries into the molecular and cellular mechanisms of this phenomenon and its impact on mammalian behavior

Extended Larché–Cahn framework for reactive Cahn–Hilliard multicomponent systems

At high temperature and pressure, solid diffusion and chemical reactions between rock minerals lead to phase transformations. Chemical transport during uphill diffusion causes phase separation, that is, spinodal decomposition. Thus, to describe the coarsening kinetics of the exsolution microstructure, we derive a thermodynamically consistent continuum theory for the multicomponent Cahn–Hilliard equations while accounting for multiple chemical reactions and neglecting deformations. Our approach considers multiple balances of microforces augmented by multiple component content balance equations within an extended Larché–Cahn framework. As for the Larché–Cahn framework, we incorporate into the theory the Larché–Cahn derivatives with respect to the phase fields and their gradients. We also explain the implications of the resulting constrained gradients of the phase fields in the form of the gradient energy coefficients. Moreover, we derive a configurational balance that includes all the associated configurational fields in agreement with the Larché–Cahn framework. We study phase separation in a three-component system whose microstructural evolution depends upon the reaction–diffusion interactions and to analyze the underlying configurational fields. This simulation portrays the interleaving between the reaction and diffusion processes and how the configurational tractions drive the motion of interfaces