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Search results for: crash test simulations
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Performance of extended Lagrangian schemes for molecular dynamics simulations with classical polarizable force fields and density functional theory
PublicationIterative energy minimization with the aim of achieving self-consistency is a common feature of Born-Oppenheimer molecular dynamics (BOMD) and classical molecular dynamics with polarizable force fields. In the former, the electronic degrees of freedom are optimized, while the latter often involves an iterative determination of induced point dipoles. The computational effort of the self-consistency procedure can be reduced by re-using...
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The Role of Molecular Structure in Monte Carlo Simulations of the Secondary Electron Yield and Backscattering Coefficient from Methacrylic Acid
PublicationIn this paper, we show the influence of the chemical structure of four different conformers on the secondary electron emission and backscattering of an electron beam from a gel of methacrylic acid. The conformers have different permanent dipole moments, which determines the cross sections for elastic collisions with electrons. The cross sections are used in Monte Carlo simulations of an electron beam, which enters the gel of methacrylic...
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Coda wave interferometry in monitoring the fracture process of concrete beams under bending test
PublicationEarly detection of damage is necessary for the safe and reliable use of civil engineering structures made of concrete. Recently, the identification of micro-cracks in concrete has become an area of growing interest, especially using wave-based techniques. In this paper, a non-destructive testing approach for the characterization of the fracture process was presented. Experimental tests were made on concrete beams subjected to mechanical...
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Comparison of pavement noise properties on selected road sections using different CPX measuring systems: self-powered vehicle and special test trailer
PublicationThe recently published ISO standard intended to measure the noise properties of road surfaces in a standardized method (ISO 11819-2:2017) precisely defines measurement procedure of the influence of road surface on traffic noise. According to it, two types of test vehicles may be utilized: a self-powered vehicle fitted with one or more test tyres and a trailer towed by a separate vehicle with one or more test tyres mounted on the...
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Electrical Simulations of the SIS100 Superconducting Dipole and Quadrupole Circuits: Transients, Earthing and Failure Modes
PublicationThe 100 Tm superconducting synchrotron SIS100 is the main accelerator of the international Facility for Antiproton and Ion Research (FAIR) currently under advanced construction in Darmstadt, Germany. The SIS100 dipole circuit which creates the magnetic field required to bend the beam, consists of 108 dipoles distributed over six arc sections of the ring. The magnetic field for the beam focusing is generated by three individual...
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Mechanical Properties of Twisted Carbon Nanotube Bundles with Carbon Linkers from Molecular Dynamics Simulations
PublicationThe manufacturing of high-modulus, high-strength fibers is of paramount importance for real-world, high-end applications. In this respect, carbon nanotubes represent the ideal candidates for realizing such fibers. However, their remarkable mechanical performance is difficult to bring up to the macroscale, due to the low load transfer within the fiber. A strategy to increase such load transfer is the introduction of chemical linkers...
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Anion–water interactions of weakly hydrated anions: molecular dynamics simulations of aqueous NaBF4 and NaPF6
PublicationIn aqueous ionic solutions, both the structure and the dynamics of water are altered dramatically with respect to the pure solvent. The emergence of novel experimental techniques makes these changes accessible to detailed investigations. At the same time, computational studies deliver unique possibilities for the interpretation of the experimental data at the molecular level. Here, using molecular dynamics simulations, we demonstrate...
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Prediction of pile shaft capacity in tension based on some direct CPT methods – Vistula Marshland test site
PublicationThis paper presents different CPT methodologies for the prediction of the pile shaft resistance in tension on the example of three reference screw piles of the Jazowa test site in Poland. The shaft capacity was estimated based on the cone resistance, sleeve friction and CPT excess pore water pressure. Three piles with a diameter of 0.4 m and the length...
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UNRES-GPU for Physics-Based Coarse-Grained Simulations of Protein Systems at Biological Time- and Size-Scales
PublicationThe dynamics of the virus like particles (VLPs) corresponding to the GII.4 Houston, GII.2 SMV, and GI.1 Norwalk strains of human noroviruses (HuNoV) that cause gastroenteritis was investigated by means of long-time (about 30 μs in the laboratory timescale) molecular dynamics simulations with the coarse-grained UNRES force field. The main motion of VLP units turned out to be the bending at the junction between the P1 subdomain (that...
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Communication and Load Balancing Optimization for Finite Element Electromagnetic Simulations Using Multi-GPU Workstation
PublicationThis paper considers a method for accelerating finite-element simulations of electromagnetic problems on a workstation using graphics processing units (GPUs). The focus is on finite-element formulations using higher order elements and tetrahedral meshes that lead to sparse matrices too large to be dealt with on a typical workstation using direct methods. We discuss the problem of rapid matrix generation and assembly, as well as...
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Structural and dynamic insights on the EmrE protein with TPP+ and related substrates through molecular dynamics simulations
PublicationEmrE is a bacterial transporter protein that forms an anti-parallel homodimer with four transmembrane helices in each monomer. EmrE transports positively charged aromatic compounds, such as TPP+ and its derivatives. We performed molecular dynamics (MD) simulations of EmrE in complex with TPP+, MeTPP+, and MBTPP+ embedded in a membrane. The detailed molecular properties and interactions were analysed for all EmrE-ligand complexes....
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EH36 steel for shipbuilding - tensile test record
Open Research DataThe basic method of ductility designation of structural steels is the Charpy impact test. The test consists of a single strike of the specimen using a Charpy pendulum. Its result is the value of work necessary to break a specimen at a test temperature. Despite its many advantages, such as its short implementation time and low costs, it has its disadvantages,...
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Effect of osmolytes on the thermal stability of proteins: replica exchange simulations of Trp-cage in urea and betaine solutions
PublicationAlthough osmolytes are known to modulate the folding equilibrium, the molecular mechanism of their effect on thermal denaturation of proteins is still poorly understood. Here, we simulated the thermal denaturation of a small model protein (Trp-cage) in the presence of denaturing (urea) and stabilizing (betaine) osmolytes, using the all-atom replica exchange molecular dynamics simulations. We found that urea destabilizes Trp-cage...
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Positively aware : the monthly journal of the Test Positive Aware Network
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Usefulness of Toxoplasma gondii recombinant antigens (GRA1, GRA7 and SAG1) in an immunoglobulin G avidity test for the serodiagnosis of toxoplasmosis
PublicationOpisano wykorzystanie mieszanki trzech antygenów rekombinantowych (GRA1, GRA7 i SAG1) Toxoplasma gondii w serodiagnostyce toksoplazmozy z wykorzystaniem oznaczenia awidności przeciwciał klasy IgG. Zastosowana mieszanka może z powodzeniem zastąpić całkowity lizat antygenów natywnych który obecnie stosowany jest w komercyjnie dostępnych zestawach. Ponadto wykazano, że zastosowane antgeny rekombinantowe różnicują fazy choroby lepiej...
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Network design for surface water quality monitoring in a road construction project using Gamma Test theory
PublicationRoad construction has a negative environmental impact on the surrounding aquatic environment, requiring the continuous monitoring of surface water quality. Here, optimization of the water quality monitoring network (WQMN) is an essential step in supporting the sustainable development of road construction projects. This study introduces Gamma Test theory (GTT) as a practical method for optimizing the WQMN of surface waters during...
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Prediction of cast-in-place concrete strength of the extradosed bridge deck based on temperature monitoring and numerical simulations
PublicationThe work is devoted to the implementation of a monitoring system for high performance concrete embedded in the span of an extradosed bridge deck using a modified maturity method augmented by numerical simulations conducted by the authors’ FEM code. The paper presents all research stages of bridge construction and considers the conclusions drawn from the results of laboratory tests, field measurements, and numerical calculations....
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Strucutral steel - tensile test results
Open Research DataModern floating structures such as ships, oil platforms and offshore wind towers are built mostly of structural steel. It is a material that is subject to requirements which, when met, allows the construction and safe operation of the structure throughout its entire work cycle. One of the basic criteria that a material must meet is its strength. The...
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Cost‐efficient performance‐driven modelling of multi‐band antennas by variable‐fidelity electromagnetic simulations and customized space mapping
PublicationElectromagnetic (EM) simulations have become an indispensable tool in the design of contemporary antennas. EM‐driven tasks, for example, parametric optimization, entail considerable computational efforts, which may be reduced by employing surrogate models. Yet, data‐driven modelling of antenna characteristics is largely hindered by the curse of dimensionality. This may be addressed using the recently reported domain‐confinement...
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Electrochemical investigations of Al–Mg alloy subjected to tensile test
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Test of an Optimised Exact-Diagonalization Approach for Trapped Fermionic Mixtures
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Test limitations induced by fault-driven instability of analog circuits.
PublicationCelem pracy jest ocena ograniczeń testowania uszkodzeń parametrycznych wynikajacych z utraty stabilności przez testowany układ analogowy. Zastosowano metody zapożyczone z teorii sterowania: liniową transformacje frakcyjną i analizę metodą strukturalnych wartości szczególnych. Przykładowej analizie poddano filtr typu leapfrog. Do obliczeń wykorzystano środowisko Matlab/Simulink. Wyniki obliczeń wykazały dużą podatność testowanego...
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Test objects for MRI quality assurance based on polymer gels
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Electrochemical investigations of Al-Mg alloy subjected to tensile test
PublicationWykonano pomiary elektrochemiczne stopu typu Al-Mg podczas badań mechanicznych polegających na rozciąganiu badanych próbek. W trakcie badań mechanicznych wykonywano badania za pomocą metody dynamicznej spektroskopii impedancyjnej (DEIS). Stwierdzono, że podczas realizacji rozciągania próbek zachodzi proces pękania warstwy pasywnej w wyniku którego rozpoczynają się procesy korozyjne. W zakresie plastycznym podczas rozciągania zarejestrowano...
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The usfulness of the SLUMS test for diagnosis of mild cognitive impairment and dementia
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The Present Utility of the Oxytocin Challenge Test—A Single-Center Study
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Comparison of Tracking Methods in Respect of Automation of Animal Behavioral Test
PublicationAutomation in experiments carried out on animals is getting more and more important in research. Computers take over laborious and time-consuming activities like recording and analysing images of experiment scene. The first step in an image analysis is finding and distinguishing between the observed animals, and then tracking all objects during the experiment. In this paper four tracking methods are presented. Quantitative and...
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FPGA-based cavity simulator and controller for TESLA test facility
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Effect of adhesive compliance in the assessment of soft adhesives with the wedge test
PublicationWedge tests are usually analysed assuming that the free, unbonded members may be treated as encastré cantilever beams. However, if the adhesive layer is sufficiently flexible (e.g., due to low elastic modulus), then significant strain in the bonded region may occur and lead to modification of the behaviour outside this region. Using in conjunction a sensitive strain gauge method on asymmetric wedge tests and a mathematical analysis...
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Employing fuzzy logic to processing of loudness scaling test results
PublicationW procesie dopasowania współczesnych aparató słuchowych wymagana jest znajomość charakterystyki dynamiki słyszenia. Charaketrystyka dynamiki słyszenia wyznaczana jest na podstawie wyników testu skalowania głośności. Problem w tym, że wyniki testu skalowania głośności wyrażone są w skali kategorii oceny wrażenia głośności, natomiast aparaty słuchowe wymagają parametrów określonych na skali numerycznej. Logika rozmyta jest jedną...
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The uses of the pressuremeter test for the design of north transversal tunnel in Grenoble
PublicationWyniki otrzymane z badań presjometrycznych wykorzystano do obliczeń statycznych za pomocą programu Extreme, którym wyznacza się wartość średnią X, odchylenie standardowe, wartość charakterystyczną Xk i rozkład teoretyczny każdego z parametrów. Obliczono wartość charakterystyczną kąta tarcia wewnętrznego dla każdego rodzaju gruntów z prawdopodobieństwem Alfa (równym 5%). Badano rozkłady: normalny, log normalny, wykładniczy, Weybulla,...
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Generation of conformance test suites for parallel and distributed languages and APIS.
PublicationArtykuł zarysowuje nową metodologię systematycznego tworzenia Zestawów Testów Zgodności. Testowanie zgodności ma na celu sprawdzenie, czy implementacja jest zgodna ze swoją specyfikacją, co jest szczególnie ważne w środowiskach równoległych i rozproszonych, gdzie musi ze sobą współpracować wiele różnych pakietów. Autor rozpoczął swoje badania w dziedzinie testowania zgodności dla języka równoległego sterowanego danymi Athapascan,...
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Screw displacement pile shaft deformations measured by vibrating wire and fiber optic systems during a static load test
PublicationThis paper describes a full scale static load test performed on a 400 mm diameter screw displacement pile equipped with four different strain measuring systems. Three types of vibrating wire strain gauges (VWSG) were used: global - retrievable, local attached to steel pipe and local concrete embedded. The fourth system was distributed fiber optic sensors based on Rayleigh back scattering (DFOS) - three in the pile cross section....
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DETERMINATION OF THE HYDROXYL NUMBER OF GROUND TIRE RUBBER PARTICLES VIA MODIFIED TEST METHOD FOR ISOCYANATE GROUPS
PublicationNowadays, considering the environmental trends and law regulations associated with the circular economy, it is very important to seek for the methods of by-products and waste utilization. The example of such material, which requires the attention and recycling method is ground tire rubber generated during recycling of post-consumer car tires. It can be introduced into various polymer matrices as a filler, but to enhance its effectivity...
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Molecular dynamics simulations of the affinity of chitin and chitosan for collagen: the effect of pH and the presence of sodium and calcium cations
PublicationChitosan and chitin are promising biopolymers used in many areas including biomedical applications, such as tissue engineering and viscosupplementation. Chitosan shares similar properties with hyaluronan, a natural component of synovial fluid, making it a good candidate for joint disease treatment. The structural and energetic consequences of intermolecular interactions are crucial for understanding the biolubrication phenomenon...
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Fast tolerance-aware design optimization of miniaturized microstrip couplers using variable-fidelity EM simulations and re-sponse features
PublicationManufacturing tolerances and other types of uncertainties may considerably affect operation and performance of microwave components and systems. Quantification of these effects is therefore an important part of the design process. It is even more important to obtain designs whose sensitivity to parameter deviations is reduced as much as possible. All of these require statistical analysis carried out at the level of electromagnetic...
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Result of the 6-min walk test is an independent prognostic factor of surgically treated non-small-cell lung cancer
PublicationPathological tumour, node and metastasis (TNM) stage remains the most significant prognostic factor of non-small-cell lung cancer (NSCLC). Meanwhile, age, gender, pulmonary function tests, the extent of surgical resection and the presence of concomitant diseases are commonly used to complete the prognostic profile of the patient with early stage of NSCLC. The aim of this study is to assess how the result of a 6-min walk test (6MWT)...
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Simulations of impact force spectrum for earthquake-induced structural pounding.
PublicationCelem artykułu jest analiza możliwości zastosowanie tzw. spektrum siły zderzenia przy projektowaniu sąsiadujących ze sobą konstrukcji budowlanych na terenach sejsmicznych, w przypadku zbyt małej przerwy dylatacyjnej między nimi. W artykule przedstawiono wyniki symulacji numerycznych przeprowadzonych dla różnych wartości parametrów dynamicznych konstrukcji.
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Representation of magnetic hysteresis in single-phase transformer for circuit simulations
PublicationThe paper presents a mathematical model for the hysteresis phenomenon in a multi-winding single-phase core type transformer. In the circuit transformer model, it is assumed that there is a flux common Φ to all windings as nonlinear and hysteretic function of the total currents Θ (Ampere turns) of all windings. To simulate magnetic behaviour of the iron core the feedback scalar Preisach model of hysteresis is developed. The Preisach...
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OpenGL accelerated method of the material matrix generation for FDTD simulations
PublicationThis paper presents the accelerated technique of the material matrix generation from CAD models utilized by the finite-difference time-domain (FDTD) simulators. To achieve high performance of these computations, the parallel-processing power of a graphics processing unit was employed with the use of the OpenGL library. The method was integrated with the developed FDTD solver, providing approximately five-fold speedup of the material...
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Electromagnetic Simulations with 3D FEM and Intel Optane Persistent Memory
PublicationAbstract—Intel Optane persistent memory has the potential to induce a change in how high-performance calculations requiring a large system memory capacity are conducted. This article presents what this change may look like in the case of factorization of large sparse matrices describing electromagnetic problems arising in the 3D FEM analysis of passive highfrequency components. In numerical tests, the Intel oneAPI MKL PARDISO was...
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Simulations of fracture in concrete elements using continuous and discontinuous models
PublicationArtykuł przedstawia wyniki symulacji MES w elementach betonowych przy zastosowaniu modeli ciągłych i nieciągłych. Stosując modele ciągłe symulowano proces lokalizacji odkształceń. Stosując modele nieciągłe symulowano proces zarysowania. Obliczenia wykonano dla różnych typów obciążeń.
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Numerical heat transfer model in skin burn depth simulations
PublicationW artykule przedstawiono numeryczny model wymiany ciepła zachodzącej w tkance skórnej . Wyniki symulacji na modelu zostały porównane z wynikami pomiarów In vivo na zwierzętach.
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Hydroacoustic signals simulations in workstation for training asw helicopter navigators
PublicationPolska Marynarka Wojenna użytkuje śmigłowce wyposażone w systemy pokładowe zmoderni-zowane w ostatnich latach a przeznaczone do wykrywania i śledzenia okrętów podwodnych: sonary z opuszczaną anteną, odbiorniki do nasłuchu i analizy sygnałów z radiohydroboi oraz magnetometry. W artykule przedstawiono pokrótce strukturę trenażera nawigatorów - operatorów tych systemów, wykorzystywanego również jako stanowisko do analizy danych zebranych...
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Polymerization and Structure of Opposing Polymer Brushes Studied by Computer Simulations
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Numerical Simulations of Laser and Hybrid S700MC T-Joint Welding
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Computational Techniques in Numerical Simulations of Arc and Laser Welding Processes
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Measurements and numerical simulations of laser hardening and remelting thermal cycles
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APPLICATION OF NUMERICAL SIMULATIONS ON X10CRWMOVNB9-2 STEEL MULTILAYER WELDING
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Reduction of Computational Complexity in Simulations of the Flow Process in Transmission Pipelines
PublicationThe paper addresses the problem of computational efficiency of the pipe-flow model used in leak detection and identification systems. Analysis of the model brings attention to its specific structure, where all matrices are sparse. With certain rearrangements, the model can be reduced to a set of equations with tridiagonal matrices. Such equations can be solved using the Thomas algorithm. This method provides almost the same values...