Frequency-Dependent Dielectric Permittivity in Poisson-Nernst-Planck Model.

The approaches developed for studying the polarization of molecules and the dynamics of ions in dielectric materials are usually considered separately. The two effects are often believed to take place in different frequency ranges. The low frequency response is usually dominated by ionic migration, whereas the high frequency response is played by molecular polarization. The goal here is to clarify the interplay between free and bound charge densities and their influences on permittivity and impedance profiles by proposing a version of the Poisson-Nernst-Planck (PNP) model that allows to include the effect of a frequency-dependent (and thus not instantaneous) polarizability.

Multivariate analysis of mean Raman spectra of erythrocytes for a fast analysis of the biochemical signature of ageing.

Ageing of red blood cells (RBC) is a physiological process, fundamental to ensure a proper blood homeostasis that, in vivo, balances the production of new cells and the removal of senescent erythrocytes. A detailed characterization at the cellular level of the progression of the ageing phenomenon can reveal biological, biophysical and biochemical fingerprints for diseases related to misbalances of the cell turnover and for blood pathologies. We applied Principal Components Analysis (PCA) to mean Raman spectra of single cells at different ageing times to rapidly highlight subtle spectral differences associated with conformational and biochemical modifications. Our results demonstrate a two-step ageing process characterized by a first phase in which proteins plays a relevant role, followed by a further cellular evolution driven by alterations in the membrane lipid contribution. Moreover, we used the same approach to directly analyse relevant spectral effects associated to reduction in Haemoglobin oxygenation level and membrane fluidity induced by the ageing. The method is robust and effective, allowing to classify easily the studied cells based on their age and morphology, and consequently to evaluate the biological quality of a blood sample.

Generalized Cattaneo (telegrapher's) equations in modeling anomalous diffusion phenomena.

We study generalized Cattaneo (telegrapher's) equations involving memory effects introduced by smearing the time derivatives. Consistency conditions where the smearing functions obey restrict freedom in their choice but the proposed scheme goes beyond the approach based on using fractional derivatives. We find conditions under which solutions of the equations considered so far can be recognized as probability distributions, i.e., are normalizable and nonnegative on their domains. Nonnegativity of solutions is demonstrated by methods of positive definite and completely monotonic functions with the Bernstein theorem being the cornerstone of the ongoing proofs. Analysis of exactly solvable examples and relevant mean-squared displacements enables us to classify diffusion processes described by such got solutions and to identify them with either ordinary or anomalous diffusion which character may change over time. To complete the present research we compare our results with those obtained using the continuous-time random-walk and the continuous-time persistent random-walk approaches.

Quenched and annealed disorder mechanisms in comb models with fractional operators.

Recent experimental findings on anomalous diffusion have demanded novel models that combine annealed (temporal) and quenched (spatial or static) disorder mechanisms. The comb model is a simplified description of diffusion on percolation clusters, where the comblike structure mimics quenched disorder mechanisms and yields a subdiffusive regime. Here we extend the comb model to simultaneously account for quenched and annealed disorder mechanisms. To do so, we replace usual derivatives in the comb diffusion equation by different fractional time-derivative operators and the conventional comblike structure by a generalized fractal structure. Our hybrid comb models thus represent a diffusion where different comblike structures describe different quenched disorder mechanisms, and the fractional operators account for various annealed disorder mechanisms. We find exact solutions for the diffusion propagator and mean square displacement in terms of different memory kernels used for defining the fractional operators. Among other findings, we show that these models describe crossovers from subdiffusion to Brownian or confined diffusions, situations emerging in empirical results. These results reveal the critical role of interactions between geometrical restrictions and memory effects on modeling anomalous diffusion.

Extensions and solutions for nonlinear diffusion equations and random walks.

We investigate a connection between random walks and nonlinear diffusion equations within the framework proposed by Einstein to explain the Brownian motion. We show here how to properly modify that framework in order to handle different physical scenarios. We obtain solutions for nonlinear diffusion equations that emerge from the random walk approach and analyse possible connections with a generalized thermostatistics formalism. Finally, we conclude that fractal and fractional derivatives may emerge in the context of nonlinear diffusion equations, depending on the choice of distribution functions related to the spreading of systems.

Reliability of Poisson-Nernst-Planck Anomalous Models for Impedance Spectroscopy.

We investigate possible connections between two different implementations of the Poisson-Nernst-Planck (PNP) anomalous models used to analyze the electrical response of electrolytic cells. One of them is built in the framework of the fractional calculus and considers integro-differential boundary conditions also formulated by using fractional derivatives; the other one is an extension of the standard PNP model presented by Barsoukov and Macdonald, which can also be related to equivalent circuits containing constant phase elements (CPEs). Both extensions may be related to an anomalous diffusion with subdiffusive characteristics through the electrical conductivity and are able to describe the experimental data presented here. Furthermore, we apply the Bayesian inversion method to extract the parameter of interest in the analytical formulas of impedance. To resolve the corresponding inverse problem, we use the delayed-rejection adaptive-Metropolis algorithm (DRAM) in the context of Markov-chain Monte Carlo (MCMC) algorithms to find the posterior distributions of the parameter and the corresponding confidence intervals.

Enhanced recovery after surgery efficacy in an older patients and high-risk population affected by colorectal cancer: a more than 1000 patients experience.

AIM: Enhanced recovery after surgery programs aims to standardize care, improving colorectal surgery outcomes. Older patients are a challenge population for these programs. The aim of this manuscript is to explore the effect of application Enhanced recovery after surgery protocol among older patients and high-risk patients undergone colorectal surgery for cancer. METHOD: Since January 2005, until September 2016, 1189 consecutive patients underwent elective Colorectal Surgery and treated according to our Enhanced recovery after surgery protocol. Patients are divided in three groups according to age: Group1 under 69 y-o (control group), Group2 70 to 79 y-o and Group3 over 80 y-o. Primary end point was Time to Readiness to Discharge. RESULTS: Median Time to Readiness to Discharge was 4 days (3-30) in Group 1, 5 (3-47) in Group 2 and 5 (3-19) in Group 3. Length of stay in Group 1 had a median length of 6 days (3-58), in Group 2 of 8 days (3-70) and in Group 3 of 8 days (3-53). CONCLUSIONS: Once more Enhanced recovery after surgery program has showed its efficacy in colorectal surgery field. Moreover, our experience has underlined the need to concentrate efforts mainly on older and high-risk patients.

Effect of dynamically changing the substrate's easy axis on the response time of nematic samples.

Recent discoveries of advanced photocontrolled materials have kindled a great deal of interest on their use as command surfaces that switch easy axis under light radiation. One noticeable point when using switchable surfaces on any application is how the dynamical process propagates to the bulk directors. In this paper, we theoretically study the effect of a relaxing easy axis over time on a nematic sample when finite anchoring energy and surface viscosity are included. We first consider the case where just one of the substrates decay over time in an initially distorted director organization. Next, we assume that both substrates can be switched simultaneously. From the calculated director we obtained the optical profile and finally the molecular response time of the material. The response time depends on both the materials and the surfaces properties including its decay time. Our results might be used for understanding and engineering liquid crystal displays and other electro-optical devices with photocontrolled alignment layers.

Insights into the morphological pattern of erythrocytes' aging: Coupling quantitative AFM data to microcalorimetry and Raman spectroscopy.

Erythrocytes (RBCs) constitute a very interesting class of cells both for their physiological function and for a variety of peculiarities. Due to their exceptionally strong relationship with the environment, the morphology and nanoscale characteristics of these cells can reveal their biochemical status and structural integrity. Among the possible subjects of investigations, the RBCs' ageing is of the utmost importance. This is a fundamental phenomenon that, in physiological conditions, triggers the cell turnover and ensures the blood homeostasis. With these premises, in recent years, we have presented an atomic force microscopy-based methodology to characterize the patterns of RBC ageing from the morphological point of view. In the present work, we used an ageing protocol more similar to the physiological conditions and we used differential scanning calorimetry and atomic force microscopy to probe the cross correlation between important structural and functional proteins. We also assessed the role played by fundamental structural and membrane proteins in the development of the most relevant morphological intermediates observed along the ageing. Furthermore, we coupled the morphological ageing patterns to the (bio)chemical alterations detected by Raman spectroscopy. This allowed identifying the chronology of the ageing morphologies and the metabolic pathways most involved in their development. As a whole, the present study provides the base to correlate specific molecular alterations to the development of structural anomalies, and these latter to the functional status of blood cells.

Surface induced twist in nematic and chiral nematic liquid crystals: stick-slip-like and constrained motion.

Surface driven pattern formation is an intriguing phenomenon in the liquid crystal field. Owing to its ability to transmit torque, one can generate different patterns by propagating distortions on the optical wavelength scale in the sample from the surface. Here, we theoretically investigate (from the elasticity point of view) twist deformations induced by a rotating easy axis at one surface, by considering the anchoring energy and surface viscosity of nematic and chiral nematic samples. The model is solved analytically in the limit of strong anchoring and numerically for a low anchoring strength situation. Such rotation could be induced, in principle, by light-controlling the orientation of an azobenzene monolayer coated at one of the glass substrates or by an in-plane rotating field. We discuss the role of the surface parameters and the different distortions, and calculate light transmission using the Jones method. Three different regimes are identified: free twist, stick-slip twist, and constrained twist. The results obtained here may be relevant for liquid crystal active waveplates and for determining surface viscosity and the azimuthal anchoring energy.

Ion Motion in Electrolytic Cells: Anomalous Diffusion Evidences.

In this study, we argue that ion motion in electrolytic cells containing Milli-Q water, weak electrolytes, or liquid crystals may exhibit unusual diffusive regimes that deviate from the expected behavior, leading the system to present an anomalous diffusion. Our arguments lie on the investigation of the electrical conductivity and its relationship with the mean square displacement, which may be used to characterize the ionic motion. In our analysis, the Poisson-Nernst-Planck diffusional model is used with extended boundary conditions to simulate the charge transfer, accumulation, and/or adsorption-desorption at the electrode surfaces.

Entropic nonadditivity, H theorem, and nonlinear Klein-Kramers equations.

We use the H theorem to establish the entropy and the entropic additivity law for a system composed of subsystems, with the dynamics governed by the Klein-Kramers equations, by considering relations among the dynamics of these subsystems and their entropies. We start considering the subsystems governed by linear Klein-Kramers equations and verify that the Boltzmann-Gibbs entropy is appropriated to this dynamics, leading us to the standard entropic additivity, S_{BG}^{(1∪2)}=S_{BG}^{1}+S_{BG}^{2}, consistent with the fact that the distributions of the subsystem are independent. We then extend the dynamics of these subsystems to independent nonlinear Klein-Kramers equations. For this case, the results show that the H theorem is verified for a generalized entropy, which does not preserve the standard entropic additivity for independent distributions. In this scenario, consistent results are obtained when a suitable coupling among the nonlinear Klein-Kramers equations is considered, in which each subsystem modifies the other until an equilibrium state is reached. This dynamics, for the subsystems, results in the Tsallis entropy for the system and, consequently, verifies the relation S_{q}^{(1∪2)}=S_{q}^{1}+S_{q}^{2}+(1-q)S_{q}^{1}S_{q}^{2}/k, which is a nonadditive entropic relation.

Anomalous diffusion and transport in heterogeneous systems separated by a membrane.

Diffusion of particles in a heterogeneous system separated by a semipermeable membrane is investigated. The particle dynamics is governed by fractional diffusion equations in the bulk and by kinetic equations on the membrane, which characterizes an interface between two different media. The kinetic equations are solved by incorporating memory effects to account for anomalous diffusion and, consequently, non-Debye relaxations. A rich variety of behaviours for the particle distribution at the interface and in the bulk may be found, depending on the choice of characteristic times in the boundary conditions and on the fractional index of the modelling equations.

Diffusion Processes and Drug Release: Capsaicinoids - Loaded Poly (ε-caprolactone) Microparticles.

We present a generalmodel based on fractional diffusion equation coupled with a kinetic equation through the boundary condition. It covers several scenarios that may be characterized by usual or anomalous diffusion or present relaxation processes on the surface with non-Debye characteristics. A particular case of this model is used to investigate the experimental data obtained from the drug release of the capsaicinoids-loaded Poly (ε-caprolactone) microparticles. These considerations lead us to a good agreement with experimental data and to the conjecture that the burst effect, i.e., an initial large bolus of drug is released before the release rate reaches a stable profile, may be related to an anomalous diffusion manifested by the system.

Analogies Between the Cracking Noise of Ethanol-Dampened Charcoal and Earthquakes.

We report on an extensive characterization of the cracking noise produced by charcoal samples when dampened with ethanol. We argue that the evaporation of ethanol causes transient and irregularly distributed internal stresses that promote the fragmentation of the samples and mimic some situations found in mining processes. The results show that, in general, the most fundamental seismic laws ruling earthquakes (the Gutenberg-Richter law, the unified scaling law for the recurrence times, Omori's law, the productivity law, and Båth's law) hold under the conditions of the experiment. Some discrepancies were also identified (a smaller exponent in the Gutenberg-Richter law, a stationary behavior in the aftershock rates for long times, and a double power-law relationship in the productivity law) and are related to the different loading conditions. Our results thus corroborate and elucidate the parallel between the seismic laws and fracture experiments caused by a more complex loading condition that also occurs in natural and induced seismicity (such as long-term fluid injection and gas-rock outbursts in mining processes).

Nonlinear Kramers equation associated with nonextensive statistical mechanics.

Stationary and time-dependent solutions of a nonlinear Kramers equation, as well as its associated nonlinear Fokker-Planck equations, are investigated within the context of Tsallis nonextensive statistical mechanics. Since no general analytical time-dependent solutions are found for such a nonlinear Kramers equation, an ansatz is considered and the corresponding asymptotic behavior is studied and compared with those known for the standard linear Kramers equation. The H-theorem is analyzed for this equation and its connection with Tsallis entropy is investigated. An application is discussed, namely the motion of Hydra cells in two-dimensional cellular aggregates, for which previous measurements have verified q-Gaussian distributions for velocity components and superdiffusion. The present analysis is in quantitative agreement with these experimental results.

Role of photophysics processes in thermal lens spectroscopy of fluids: a theoretical study.

Photophysics processes are ubiquitous in nature and difficult to be quantitatively characterized by conventional spectroscopy. Alternatively, pump-probe methods have been widely applied to study these complex processes. In this context, the thermal lens technique is a precise spectroscopic tool for material characterization and presents a wide range of applications in chemical analysis. Here, we present an all numerical approach to analyze the dynamics of photophysics processes and to identify the role of individual contributions of photoreaction and mass diffusion in the thermal lens experiments. The results are essential for a proper understanding of the dominant physical mechanisms in laser-induced photodegradation, which allow precise data analysis of the effects in photosensitive fluids.

Universal bursty behaviour in human violent conflicts.

Understanding the mechanisms and processes underlying the dynamics of collective violence is of considerable current interest. Recent studies indicated the presence of robust patterns characterizing the size and timing of violent events in human conflicts. Since the size and timing of violent events arises as the result of a dynamical process, we explore the possibility of unifying these observations. By analyzing available catalogs on violent events in Iraq (2003-2005), Afghanistan (2008-2010) and Northern Ireland (1969-2001), we show that the inter-event time distributions (calculated for a range of minimum sizes) obeys approximately a simple scaling law which holds for more than three orders of magnitude. This robust pattern suggests a hierarchical organization in size and time providing a unified picture of the dynamics of violent conflicts.

Engagement in the electoral processes: scaling laws and the role of political positions.

We report on a statistical analysis of the engagement in the electoral processes of all Brazilian cities by considering the number of party memberships and the number of candidates for mayor and councillor. By investigating the relationships between the number of party members and the population of voters, we have found that the functional forms of these relationships are well described by sublinear power laws (allometric scaling) surrounded by a multiplicative log-normal noise. We have observed that this pattern is quite similar to those we previously reported for the relationships between the number of candidates (mayor and councillor) and population of voters [Europhys. Lett. 96, 48001 (2011)], suggesting that similar universal laws may be ruling the engagement in the electoral processes. We also note that the power-law exponents display a clear hierarchy, where the more influential is the political position the smaller is the value of the exponent. We have also investigated the probability distributions of the number of candidates (mayor and councillor), party memberships, and voters. The results indicate that the most influential positions are characterized by distributions with very short tails, while less influential positions display an intermediate power-law decay before showing an exponential-like cutoff. We discuss the possibility that, in addition to the political power of the position, limitations in the number of available seats can also be connected with this changing of behavior. We further believe that our empirical findings point out to an under-representation effect, where the larger the city is, the larger are the obstacles for more individuals to become directly engaged in the electoral process.

Antipersistent behavior of defects in a lyotropic liquid crystal during annihilation.

We report on the dynamical behavior of defects of strength s=±1/2 in a lyotropic liquid crystal during the annihilation process. By following their positions using time-resolved polarizing microscopy technique, we present statistically significant evidence that the relative velocity between defect pairs is Gaussian distributed, antipersistent, and long-range correlated. We further show that simulations of the Lebwohl-Lasher model reproduce quite well our experimental findings.