Optical modeling of organic solar cells based on CuPc and C60

We have investigated the influence of the poly(3,4-ethylenedioxythiophene)-blend-poly(styrene-sulfonate) (PEDOT:PSS) layer on the short-circuit current density (J(sc)) of single planar heterojunction organic solar cells based on a copper phthalocyanine (CuPc)-buckminsterfullerene (C(60)) active layer. Complete optical and electrical modeling of the cell has been performed taking into account optical interferences and exciton diffusion. Comparison of experimental and simulated external quantum efficiency has allowed us to estimate the exciton diffusion length to be 37 nm for the CuPc and 19 nm for the C(60). The dependence of short-circuit current densities versus the thickness of the PEDOT:PSS layer is analyzed and compared with experimental data. It is found that the variation in short-circuit current densities could be explained by optical interferences.     

Improving Biocompatibility of Implantable Metals by Nanoscale Modification of Surfaces: An Overview of Strategies,Fabrication Methods,and Challenges

The human body is an intricate biochemical–mechanical system, with an exceedingly precise hierarchical organization in which all components work together in harmony across a wide range of dimensions. Many fundamental biological processes take place at surfaces and interfaces (e.g., cell–matrix interactions), and these occur on the nanoscale. For this reason, current health‐related research is actively following a biomimetic approach in learning how to create new biocompatible materials with nanostructured features. The ultimate aim is to reproduce and enhance the natural nanoscale elements present in the human body and to thereby develop new materials with improved biological activities. Progress in this area requires a multidisciplinary effort at the interface of biology, physics, and chemistry. In this Review, the major techniques that have been adopted to yield novel nanostructured versions of familiar biomaterials, focusing particularly on metals, are presented and the way in which nanometric surface cues can beneficially guide biological processes, exerting influence on cellular behavior, is illustrated. Frontispiece adapted from Reference 94 .

     

Extension of the Stokes equation for layered constructions to fluorescent turbid media

Expressions relating the bispectral reflectance of a stack of n fluorescing layers to each individual layer's reflectance and transmittance are derived. This theoretical framework is used together with recently proposed extensions of the Kubelka-Munk model to study the fluorescence from layered turbid media. For one layer over a reflecting background, the model is shown to give the same results as a previous model. The extension to n layers with different optical properties allows simulating the bispectral reflectance from a pad of layered turbid media. The applicability of the model is exemplified with an optimization of fluorophore distribution in layered turbid media.     

3D Point Cloud Analysis for Detection and Characterization of Defects on Airplane Exterior Surface

Three-dimensional surface defect inspection remains a challenging task. This paper describes a novel automatic vision-based inspection system that is capable of detecting and characterizing defects on an airplane exterior surface. By analyzing 3D data collected with a 3D scanner, our method aims to identify and extract the information about the undesired defects such as dents, protrusions or scratches based on local surface properties. Surface dents and protrusions are identified as the deviations from an ideal, smooth surface. Given an unorganized point cloud, we first smooth noisy data by using Moving Least Squares algorithm. The curvature and normal information are then estimated at every point in the input data. As a next step, Region Growing segmentation algorithm divides the point cloud into defective and non-defective regions using the local normal and curvature information. Further, the convex hull around each defective region is calculated in order to englobe the suspicious irregularity. Finally, we use our new technique to measure the dimension, depth, and orientation of the defects. We tested and validated our novel approach on real aircraft data obtained from an Airbus A320, for different types of defect. The accuracy of the system is evaluated by comparing the measurements of our approach with ground truth measurements obtained by a high-accuracy measuring device. The result shows that our work is robust, effective and promising for industrial applications.     

Modelling of electro hydraulic free and die forming of sheet steels

Electro hydraulic forming of a range of different sheet steels was studied experimentally and with finite element methods. Four carbon and stainless sheet materials were studied. In this paper we present results on a mild steel (IF210), two high strength steels (DPX800 and TRIP700) and one stainless steel (1.4509). The flow properties of the materials were evaluated at a range of strain rates up to 1000/s. These were typical strain rates in the FE simulations. The flow properties were characterized with the Johnson Cook model. Electro hydraulic forming trails were performed with a chamber of water with a pair of electrodes on one side of the sheet. In one case free forming was performed and in the other case forming was performed into a truncated conical die. Geometrical shapes and strain distributions were evaluated after forming. A finite element model was formulated in ABAQUS explicit. The model takes the chamber filled with water into account and the effect of the electrical discharge is modeled as a pressure wave originating from the location of the electrodes. The sheet is given the properties defined by the Johnson Cook model and stiff tools are used. The forming of the sheet is described including rebound effects at the tools. The model shows satisfactory results in relation to the experimental trials regarding both shape and strains of the pressed sheets.     

Transport Map sampling with PGD model reduction for fast dynamical Bayesian data assimilation

The motivation of this work is to address real-time sequential inference of parameters with a full Bayesian formulation. First, the proper generalized decomposition (PGD) is used to reduce the computational evaluation of the posterior density in the online phase. Second, Transport Map sampling is used to build a deterministic coupling between a reference measure and the posterior measure. The determination of the transport maps involves the solution of a minimization problem. As the PGD model is quasi-analytical and under a variable separation form, the use of gradient and Hessian information speeds up the minimization algorithm. Eventually, uncertainty quantification on outputs of interest of the model can be easily performed due to the global feature of the PGD solution over all coordinate domains. Numerical examples highlight the performance of the method.     

High Efficiency Poly(acrylonitrile) Electrospun Nanofiber Membranes for Airborne Nanomaterials Filtration

The potential of poly(acrylonitrile) electrospun membranes with tuneable pore size and fiber distributions were investigated for airborne fine‐particle filtration for the first time. The impact of solution concentration on final membrane properties are evaluated for the purpose of designing separation materials with higher separation efficiency. The properties of fibers and membranes are investigated systematically: the average pore distribution, as characterized by capillary flow porometry, and thermo‐mechanical properties of the mats are found to be dependent on fiber diameter and on specific electrospinning conditions. Filtration efficiency and pressure drop are calculated from measurement of penetration through the membranes using potassium chloride (KCl) aerosol particles ranging from 300 nm to 12 μm diameter. The PAN membranes exhibited separation efficiencies in the range of 73.8–99.78% and a typical quality factor 0.0224 (1 Pa^?1) for 12 wt% PAN with nanofibers having a diameter of 858 nm. Concerning air flow rate, the quality factor and filtration efficiency of the electrospun membranes at higher face velocity are much more stable than for commercial membranes. The results suggest that the structure of electrospun membranes is the best for air filtration in terms of filtration stability at high air flow rate.

     

A damage to crack transition model accounting for stress triaxiality formulated in a hybrid nonlocal implicit discontinuous Galerkin‐cohesive band model framework

Modelling the entire ductile fracture process remains a challenge. On the one hand, continuous damage models succeed in capturing the initial diffuse damage stage but are not able to represent discontinuities or cracks. On the other hand, discontinuous methods, as the cohesive zones, which model the crack propagation behaviour, are suited to represent the localised damaging process. However, they are unable to represent diffuse damage. Moreover, most of the cohesive models do not capture triaxiality effect. In this paper, the advantages of the two approaches are combined in a single damage to crack transition framework. In a small deformation setting, a nonlocal elastic damage model is associated with a cohesive model in a discontinuous Galerkin finite element framework. A cohesive band model is used to naturally introduce a triaxiality‐dependent behaviour inside the cohesive law. Practically, a numerical thickness is introduced to recover a 3D state, mandatory to incorporate the in‐plane stretch effects. This thickness is evaluated to ensure the energy consistency of the method and is not a new numerical parameter. The traction‐separation law is then built from the underlying damage model. The method is numerically shown to capture the stress triaxiality effect on the crack initiation and propagation.     

Guaranteed error bounds on pointwise quantities of interest for transient viscodynamics problems

A new method is developed to obtain guaranteed error bounds on pointwise quantities of interest for linear transient viscodynamics problems. The calculation of strict error bounds is based on the concept of “constitutive relation error” (CRE) and the solution of an adjoint problem. The central and original point of this work is the treatment of the singularity in space and time introduced by the loading of the adjoint problem. Hence, the adjoint solution is decomposed into two parts: (i) an analytical part determined from Green’s functions; (ii) a residual part approximated with classical numerical tools (finite element method, Newmark integration scheme). The capabilities and the limits of the proposed approach are analyzed on a 2D example.