Modelling of macrophage responses to biomaterials : state-of-the-art and the need for the improvement.

The increasing use of medical implants in various areas of medicine, particularly in orthopedic surgery, oncology, cardiology and dentistry, displayed the limitations in long-term integration of available biomaterials. The effective functioning and successful integration of implants requires not only technical excellence of materials but also consideration of the dynamics of biomaterial interaction with the immune system throughout the entire duration of implant use. The acute as well as long-term decisions about the efficiency of implant integration are done by local resident tissue macrophages and monocyte-derived macrophages that start to be recruited during tissue damage, when implant is installed, and are continuously recruited during the healing phase.

Prediction of Fracture Toughness of Pultruded Composites Based on Supervised Machine Learning.

Prediction of mechanical properties is an essential part of material design. State-of-the-art simulation-based prediction requires data on microstructure and inter-component interactions of material. However, due to high costs and time limitations, such parameters, which are especially required for the simulation of advanced properties, are not always available.

Application of two-component neural network for exchange-correlation functional interpolation.

Density functional theory (DFT) is one of the primary approaches to solving the many-body Schrodinger equation. The essential part of the DFT theory is the exchange-correlation (XC) functional, which can not be obtained in analytical form. Accordingly, the accuracy improvement of the DFT is mainly based on the development of XC functional approximations.

Effects of the Pre-Consolidated Materials Manufacturing Method on the Mechanical Properties of Pultruded Thermoplastic Composites.

The choice of a manufacturing process, raw materials, and process parameters affects the quality of produced pre-consolidated tapes used in thermoplastic pultrusion. In this study, we used two types of pre-consolidated GF/PP tapes-commercially available (ApATeCh-Tape Company, Moscow, Russia) and inhouse-made tapes produced from commingled yarns (Jushi Holdings Inc., Boca Raton, FL, USA)-to produce pultruded thermoplastic Ø 6 mm bars and 75 mm × 3.

Biodegradable iron-silicon implants produced by additive manufacturing.

Due to many negative and undesirable side effects from the use of permanent implants, the development of temporary implants based on biocompatible and biodegradable materials is a promising area of modern medicine. In the presented study, we have investigated complex-shaped iron-silicon (Fe-Si) scaffolds that can be used as potential biodegradable framework structures for solid implants for bone grafting. Since iron and silicon are biocompatible materials, and their alloy should also have biocompatibility.

Relation between Charging Times and Storage Properties of Nanoporous Supercapacitors.

An optimal combination of power and energy characteristics is beneficial for the further progress of supercapacitors-based technologies. We develop a nanoscale dynamic electrolyte model, which describes both static capacitance and the time-dependent charging process, including the initial square-root dependency and two subsequent exponential trends. The observed charging time corresponds to one of the relaxation times of the exponential regimes and significantly depends on the pore size.

Anisotropy of Mechanical Properties and Residual Stress in Additively Manufactured 316L Specimens.

In the presented study, LPBF 316L stainless steel tensile specimens were manufactured in three different orientations for the analysis of anisotropy. The first set of specimens was built vertically on the build platform, and two other sets were oriented horizontally perpendicular to each other. Tensile test results show that mean Young's modulus of vertically built specimens is significantly less then horizontal ones (158.

Extension of van der Waals theory for supersaturated thin films.

The vapor/liquid interface properties play an essential role in both fundamental models and practical applications. Here, we describe a thin planar film surrounded by supersaturated vapor using the extension of van der Waals theory. We derive the analytical equilibrium conditions, which allow us to define the stress tensor and surface tension.

Modification of Mechanical Properties in Directed Energy Deposition by a Static Magnetic Field: Experimental and Theoretical Analysis.

The superimposed magnetic field affects the microstructure and mechanical properties of additively manufactured metal parts. In this work, the samples were fabricated from Inconel 718 superalloy by directed energy deposition under a 0.2 T static field.

Modeling Spring-In of L-Shaped Structural Profiles Pultruded at Different Pulling Speeds.

Cure-induced deformations are inevitable in pultruded composite profiles due to the peculiarities of the pultrusion process and usually require the use of costly shimming operations at the assembly stage for their compensation. Residual stresses formed at the production and assembly stages impair the mechanical performance of pultruded elements. A numerical technique that would allow the prediction and reduction of cure-induced deformations is essential for the optimization of the pultrusion process.

Energy of a Drop Required to Break a Liquid Film.

An external disturbance can destabilize and break a liquid film on a nonwettable surface. Previous studies focused on evaluating critical film thickness for a spontaneous breakup, but the required energy has been unknown. We experimentally found that the energy of a drop to break a liquid film is an order of magnitude more than that predicted by a free energy balance.

Dynamics of an externally driven cavitation bubble in an elastic microconfinement.

The subject of the present study is the dynamics of a single cavitation bubble in a spherical liquid cell surrounded by an infinite elastic solid. It is shown that volume confinement strongly affects the manifestation of the classical cavitation Blake threshold. In particular, at liquid cell sizes smaller than some critical size, the cavitation is completely suppressed by volumetric confinement.

Electrolyte structure near electrodes with molecular-size roughness.

Understanding electrodes' surface morphology influence on ions' distribution is essential for designing supercapacitors with enhanced energy density characteristics. We develop a model for the structure of electrolytes near the rough surface of electrodes. The model describes an effective electrostatic field's increase and associated intensification of ions' spatial separation at the electrode-electrolyte interface.

Thermoplastic Pultrusion: A Review.

Pultrusion is one of the most efficient methods of producing polymer composite structures with a constant cross-section. Pultruded profiles are widely used in bridge construction, transportation industry, energy sector, and civil and architectural engineering. However, in spite of the many advantages thermoplastic composites have over the thermoset ones, the thermoplastic pultrusion market demonstrates significantly lower production volumes as compared to those of the thermoset one.

Hardening of Additive Manufactured 316L Stainless Steel by Using Bimodal Powder Containing Nanoscale Fraction.

The particle size distribution significantly affects the material properties of the additively manufactured parts. In this work, the influence of bimodal powder containing nano- and micro-scale particles on microstructure and materials properties is studied. Moreover, to study the effect of the protective atmosphere, the test samples were additively manufactured from 316L stainless steel powder in argon and nitrogen.

Software for Bioprinting.

The bioprinting of heterogeneous organs is a crucial issue. To reach the complexity of such organs, there is a need for highly specialized software that will meet all requirements such as accuracy, complexity, and others. The primary objective of this review is to consider various software tools that are used in bioprinting and to reveal their capabilities.

Evolution of SLA-Based AlO Microstructure During Additive Manufacturing Process.

Evolution of additively manufactured (AM) ceramics' microstructure between manufacturing stages is a hardly explored topic. These data are of high demand for advanced numerical modeling. In this work, 3D microstructural models of AlO greenbody, brownbody and sintered material are presented and analyzed, for ceramic samples manufactured with SLA-based AM workflow, using a commercially available ceramic paste and 3D printer.

Very High Cycle Fatigue Behavior of Additively Manufactured 316L Stainless Steel.

The present paper is focused on an experimental study of the damage-to-failure mechanism of additively manufactured 316L stainless steel specimens subjected to very high cycle fatigue (VHCF) loading. Ultrasonic axial tension-compression tests were carried out on specimens for up to 10 cycles, and fracture surface analysis was performed. A fine granular area (FGA) surrounding internal defects was observed and formed a "fish-eye" fracture type.

Role of Nitrogen and Oxygen in Capacitance Formation of Carbon Nanowalls.

Supercapacitors based on carbon nanomaterials are attracting much attention because of their high capacitance enabled by large specific surface area. The introduction of heteroatoms such as N or O enhances the specific capacitance of these materials. However, the mechanisms that lead to the increase in the specific capacitance are not yet well-studied.

Neural network interpolation of exchange-correlation functional.

Density functional theory (DFT) is one of the most widely used tools to solve the many-body Schrodinger equation. The core uncertainty inside DFT theory is the exchange-correlation (XC) functional, the exact form of which is still unknown. Therefore, the essential part of DFT success is based on the progress in the development of XC approximations.

Model of graphene nanobubble: Combining classical density functional and elasticity theories.

A graphene nanobubble consists of a graphene sheet, an atomically flat substrate, and a substance enclosed between them. Unlike conventional confinement with rigid walls and a fixed volume, the graphene nanobubble has one stretchable wall, which is the graphene sheet, and its volume can be adjusted by changing the shape. In this study, we developed a model of a graphene nanobubble based on classical density functional theory and the elastic theory of membranes.

Zeros of partition functions in the NPT ensemble.

Lee-Yang and Fisher zeros are crucial for the study of phase transitions in the grand canonical and the canonical ensembles, respectively. However, these powerful methods do not cover the isothermal-isobaric ensemble (NPT ensemble), which reflects the conditions of many experiments. In this work we present a theory of the phase transitions in terms of the zeros of the NPT-ensemble partition functions in the complex plane.

Towards Creation of Ceramic-Based Low Permeability Reference Standards.

Low-permeable materials, either artificial or natural, are essential components of the current technological development. Their production or processing requires a comprehensive characterization method based on confident reference standards. Permeability standards for values below 10 m are lacking.

Flexible Polycaprolactone and Polycaprolactone/Graphene Scaffolds for Tissue Engineering.

Developing bone scaffolds can greatly improve the patient's quality of life by accelerating the rehabilitation process. In this paper, we studied the process of composite polycaprolactone supercritical foaming for tissue engineering. The influence of graphene oxide and reduced graphene oxide on the foaming parameters was studied.

Modeling of the phase transition inside graphene nanobubbles filled with ethane.

Graphene nanobubbles consist of a substance that is trapped between graphene sheets and atomically flat substrates. This substance is an example of confinement in which both the bulk and surface interactions and the tension of the graphene determine the mechanical and thermodynamic properties of the system. The van der Waals pressure build up due to the graphene-substrate attraction and surface influence facilitates the advanced condensation of trapped substances.