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Search results for: charge density waves
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Detection and Imaging of Debonding in Adhesive Joints of Concrete Beams Strengthened with Steel Plates Using Guided Waves and Weighted Root Mean Square
PublicationStrengthening of engineering structures is an important issue, especially for elements subjected to variable loads. In the case of concrete beams or slabs, one of the most popular approaches assumes mounting an external reinforcement in the form of steel or composite elements by structural adhesives. A significant disadvantage of adhesive joints is the lack of access to the adhesive film for visual condition assessment, thus, there...
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Electrostatic interactions in finite systems treated with periodic boundary conditions: Application to linear-scaling density functional theory
PublicationWe present a comparison of methods for treating the electrostatic interactions of finite, isolated systems within periodic boundary conditions (PBCs), within density functional theory (DFT), with particular emphasis on linear-scaling (LS) DFT. Often, PBCs are not physically realistic but are an unavoidable consequence of the choice of basis set and the efficacy of using Fourier transforms to compute the Hartree potential. In such...
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The role of Herzberg-Teller effects on the resonance Raman spectrum of trans-porphycene investigated by time dependent density functional theory.
PublicationThe S1 excited state properties as well as the associated absorption and resonance Raman (RR) spectra of trans-porphycene are investigated by means of time dependent density functional theory calculations. The relative magnitude of the Franck-Condon (FC) contribution and of the Herzberg-Teller (HT) effects is evaluated for both the absorption and RR intensities. The accuracy of the calculated spectra is assessed by employing different...
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Density functional theory calculations on entire proteins for free energies of binding: Application to a model polar binding site
PublicationIn drug optimization calculations, the molecular mechanics Poisson-Boltzmann surface area (MM-PBSA) method can be used to compute free energies of binding of ligands to proteins. The method involves the evaluation of the energy of configurations in an implicit solvent model. One source of errors is the force field used, which can potentially lead to large errors due to the restrictions in accuracy imposed by its empirical nature....
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Density, sound velocity, viscosity, and refractive index of new morpholinium ionic liquids with amino acid-based anions: Effect of temperature, alkyl chain length, and anion
PublicationIn this work, room temperature synthesis of twenty new ionic liquids (ILs) based on the N-alkyl-N-methylmorpholinium ([Mor1,R], R = 2, 3, 4, 6, 8) cation and N-acetyl-L-amino acid anions (L-alaninate, L-valinate, L-leucinate, L-isoleucinate) was described. The synthesized ILs were characterized by various spectroscopic techniques and high-resolution mass spectrometry. Furthermore, density (ρ), sound velocity (v), viscosity (η)...
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Nonlinear Excitation of the Non-Wave Perturbations by the Magnetoacoustic Waves in the Non-Isentropic Plasma
PublicationNonlinear excitation of slow modes by the planar magnetosonic perturbations in a plasma is discussed. Plasma is an open system due to radiation and external heating. This may stipulate enhancement of wave perturbations and hence the acoustical activity of plasma. Plasma is assumed to be a homogeneous ideal gas with infinite electrical conductivity. The straight magnetic field is orthogonal to the velocity of fluid’s...
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Internal imaging of concrete fracture based on elastic waves and ultrasound computed tomography
PublicationThe condition assessment of concrete structures belongs to the greatest challenges of non-destructive testing. Monitoring the fracture process of concrete and detecting cracks at the earliest possible stage is a vital aspect to ensure the safety of civil engineering objects. The use of ultrasound tomography enables imaging the internal structure of a tested element. This study aims at the visualization of fracture damage in concrete...
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Relationsship between magnetoriction and the magnetostrictive coupling coefficient for magnetostrctive generation of elastic waves
PublicationPrzedstawiono wyniki doświadczenia z wpływem natężenia stałego pola magnety-cznego na wielkość impulsów magnetostrykcyjnych w rurze stali niskowęglowej.fala akustyczna rejestrowana była także za pomocą układu do emisji akusty-cznej. Wykazano, iż występuje minimum amplitudy impulsów magnetostrykcyjnychoraz emisji akustycznej dla natężenia pola, przy którym magnetostrykcjaosiąga wartość ekstremalną. Wyniki zapisano za pomocą...
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Theoretical study of the finite amplitude waves interaction problem for multielement radiating array.
PublicationPrzedstawiono model matematyczny i wyniki badań teoretycznych zjawiska oddziaływań fal dla źródeł biharmonicznych. Rozpatrzono dwie konfiguracje źródła. Model matematyczny zbudowano w oparciu o równanie KZK dla źródeł bez osiowej symetrii. Analizowano zmiany ciśnienia fal różnych częstotliwości w obrębie wiązki akustycznej.
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Extended phase diagram of RNiC2 family: Linear scaling of the Peierls temperature
PublicationPhysical properties for the late-lanthanide-based RNiC2 (R = Dy, Ho, Er, and Tm) ternary compounds are reported. All the compounds show antiferromagnetic ground state with the Néel temperature ranging from 3.4 K for HoNiC2 to 8.5 K for ErNiC2. The results of the transport and galvanomagnetic properties confirm a charge density wave state at and above room temperature with transition temperatures TCDW = 284, 335, 366, and 394 K for...
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Baozha Yu Chongji/Expolosion and Shock Waves
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Model-Based Decision Support System for the Blast Furnace Charge of Burden Materials
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Improvement of charge separation in TiO 2 by its modification with different tungsten compounds
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Interfacial Charge Transfer Complexes in TiO2-Enediol Hybrids Synthesized by Sol–Gel
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Blast Charge Technique as a Method of Soil Improving to Locate the New Supporting Runways
PublicationA quick and effective method of reinforcing the ground base designed for the construction of engineering structures used for performing various types of air operations was presented. It allows to use wastelands, wetlands, swamps, etc. for these purposes, thus creating a dispersed network of landing sites, increasing the access of large social groups to air transport and increasing their mobility.
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Electroabsorption study of metal-to-ligand charge transfer in an organic complex of iridium (III).
PublicationW pracy zmierzono i zinterpretowano widmo elektroabsorpcji (EA) próżniowo naparowanych warstw organicznego kompleksu Ir(ppy)3, powszechnie stosowanego jako emiter fosforescencyjny w organicznych diodach elektroluminescencyjnych. Analiza widma EA potwierdziła fakt,że niskoenergetyczne stany elektronowe tego kompleksu związane są z przeniesieniem ładunku metal-ligand.
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The Application of Kernel Density Estimation for Aided the Process of Locating Sources of Voltage Fluctuations
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Evaluation of cardiac muscle microvessel density in children diagnosed with cyanotic heart defects
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Noise spectral density computation based on finite element model of piezoceramic sensor
PublicationThe high sensitivity with wide bandwidth is required for sensor applications in non-destructive testing (NDT). The sensitivity of piezoceramic sensors demands to minimize their noise especially thermal noise, polarisation noise and low frequency 1/f noise,which are the main sources of voltage or current fluctuation in this sort of sensors. For simplicity, only the piezoceramic part of sensor was under study. the theoretical and...
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The Effects of Cross-Link Density and Chemical Exchange on Magnetization Transfer in Polyacrylamide Gels
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Surface area investigation of materials with transition layers of continuously changing electron density
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Measurements of Dispersed Phase Velocity in Two-Phase Flows in Pipelines Using Gamma-Absorption Technique and Phase of the Cross-Spectral Density Function
PublicationThis paper concerns the application of the gamma radiation absorption method in the measurements of dispersed phase velocity in two-phase flows: liquid–gas flow in a horizontal pipe- line and liquid–solid particles in a vertical pipe. Radiometric sets containing two linear 241Am gamma radiation sources and two NaI(Tl) scintillation detectors were used in the research. Due to the stochastic nature of the signals obtained from the...
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Hydrogen Production Mechanism in Low-Temperature Methanol Decomposition Catalyzed by Ni3Sn4 Intermetallic Compound: A Combined Operando and Density Functional Theory Investigation
PublicationHydrogen production from methanol decomposition to syngas (H2 + CO) is a promising alternative route for clean energy transition. One major challenge is related to the quest for stable, cost-effective, and selective catalysts operating below 400 °C. We illustrate an investigation of the surface reactivity of a Ni3Sn4 catalyst working at 250 °C, by combining density functional theory, operando X-ray absorption spectroscopy, and high-resolution...
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Fabrication of high-density nitrogen-vacancy (NV) center-enriched diamond particles through methyl trityl amine (C20H19N) seeding
PublicationDiamond particles (DPs) show promise for advanced applications in bioimaging and quantum sensing due to the presence of defect centers. This work reports a unique growth process for diamond particles composed of nitrogen-vacancy centers (NV-DPs) using a methyl trityl amine (C20H19N) diamondoid seed, which acts as a nitrogen source for NV creation. Growth was performed via microwave plasma-assisted chemical vapor deposition in a...
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Damage Detection Using Cointegration Technique and Wavelet Analysis of the Post-Cointegrated Lamb Waves
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Formulation of spectral truss element for guided waves damage detection in spatial steel trusses
PublicationW pracy przedstawiono sformułowanie wielowęzłowego elementu spektralnego oraz odpowiedniego schematu całkowania ukierunkowanego na problem propagacji fal w kratownicach przestrzennych o dowolnej geometrii. Zaproponowane podejście nie ogranicza liczby węzłów w elemencie kratowym. Porównawcze rozwiązania numeryczne przeprowadzono dla konstrukcji idealnej (w stanie nieuszkodzonym) oraz dlakonstrukcji z miejscową nieregularnością w...
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Comparison of resonance optical scattering of plane waves by infinite gratings of silver cylinders and strips
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Spectral Finite Element Method for Propagation of Elastic Waves in Wind Turbine Blades for SHM
PublicationW pracy przedstawiono model łopaty turbiny wiatrowej zbudowany z wykorzystaniem spektralnych elementów skończonych. Omówiono wyniki symulacji propagacji fal sprężystych i ich interakcji z uszkodzeniami w formie pęknięcia i delaminacji.
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Comparison of anti-plane surface waves in strain-gradient materials and materials with surface stresses
PublicationHere we discuss the similarities and differences in anti-plane surface wave propagation in an elastic half-space within the framework of the theories of Gurtin–Murdoch surface elasticity and Toupin–Mindlin strain-gradient elasticity. The qualitative behaviour of the dispersion curves and the decay of the obtained solutions are quite similar. On the other hand, we show that the solutions relating to the surface elasticity model...
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Synthesis of Bis(ethylenedithio)dithiadiazafulvalenes (BEDT-DTDAF) and Generation of Charge Transfer Complexes with Tetracyanoquinodimetane
PublicationW artykule opisana została synteza Bis(etylenoditio)ditiadiazafulwalenów (BEDT-DTDAF) wykorzystująca jako kluczowe związki przejściowe 4,5-(etylenoditio)tiazol oraz sole 3-aliklo-4,5-(etylenoditio)tiazoliowe oraz generowanie przewodzących kompleksów z przeniesieniem ładunku usyskanych z Bis(etylenoditio)ditiadiazafulwalenów oraz tetracyjanochinodimetanu.
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Electric field and charge induced quenching of luminescence in electroluminescent emitters based on lanthanide complexes
PublicationW pracy badano ładunkowe i elektrycznopolowe wygaszanie ekscytonóww układzie dwuamina TPD: organiczny kompleks europu przez pomiar zaników fotoluminescencji w zewnętrznym polu elektrycznym.
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Design and Application of Magnetic Photocatalysts for Water Treatment. The Effect of Particle Charge on Surface Functionality
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Synthesis and Characterization of Size- and Charge-Tunable Silver Nanoparticles for Selective Anticancer and Antibacterial Treatment
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The influence of charge compensation defects on the spectroscopic properties of europium doped Ca9Y(PO4)7
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Theoretical treatment of charge-transfer processes induced by collision of C^q+ ions with uracil
PublicationWychwyt ładunku został opisany teoretycznie przy użyciu podstawowych metod chemii kwantowej, uzupełnionych półklasycznym opisem dynamiki zachodzącego procesu. Otrzymane przekroje czynne pokazują zróżnicowane zachowanie pod wpływem struktury elektronowej badanego jonu i mogą służyć do wyjaśniania prowadzonych badań doświadczalnych.
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Sano-Tachiya-Noolandi-Hong versus Onsager modelling of charge photogeneration in organic solids
PublicationW pracy obliczono numerycznie charakterystyki polowe wydajności fotogeneracji nośników ładunku na gruncie różnych wesrsji modeli Onsagera i Noolandiego-Honga. Wyznaczone krzywe teoretyczne porównano z wynikami doświadczalnymi uzyskanymi metodą elektromodulacji (foto)luminescencji (EML) dla próżniowo naparowanych warstw organicznych kompleksów Alq3 i Ir(ppy)3.
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An increased skin microvessel density is associated with neurovascular complications in type 1 diabetes mellitus
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Multiaxial fatigue life assessment in notched components based on the effective strain energy density
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MicroscopicA75sNMR study of the effect of impurities on the first-order spin-density-wave transition inBaFe2As2
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Blood pressure and low-density lipoprotein-cholesterol lowering for prevention of strokes and cognitive decline
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Mechanical response of buried High-Density Polyethylene pipelines under normal fault motions
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Optimizing acoustic field intesity algorithms using the sound ray surface density method.
PublicationW artykule przedstawiono zagadnienia optymalizacji algorytmów komputerowych obliczeń rozkładów natężeń pola akustycznego w akwenie w zależności od za- mierzonych warunków hydrologicznych pod kątem skrócenia czasu obliczń.
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Magdalena Popowska dr
PeopleMagdalena Popowska (PhD) is a researcher and lecturer of Organization Science and Entrepreneurship at the Faculty of Management and Economics of Gdansk University of Technology. For many years she has been in charge of exchange programmes, double degrees and other internationalization activities. In 2008-2016 she was a Vice-Dean for International and Public Affairs and now she is a Dean Proxy for International Cooperation. Her...
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REVERSE MODELLING OF MICROSEISMIC WAVES PROPAGATION FOR THE INTERPRETATION OF THE DATA FROM HYDRAULIC FRACTURING MONITORING IN POLAND
PublicationA hydraulic fracturing job was performed to stimulate gas flow from a horizontal wellbore located in Poland. The whole operation was overseen by means of microseismic monitoring. For this purpose, an array of 12000 geophones was deployed on ground in form of patches distributed unevenly in a region of 4km from the wellbore. The array was constantly recording seismic signals during whole fracturing processed. Such recorded signals...
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Damage detection strategies for aircraft shell-like structures based on propagation guided elastic waves
PublicationW pracy przedstawiono mozliwości detekcji uszkodzeń w lotniczych konstrukcjach powłokowych z wykorzystaniem fal sprężystych. Omówiono kilka strategii detekcji uszkodzeń. Przedstawiono wyniki symulacji numerycznych z wykorzystaniem metody spektralnych elementów skończonych, jak również wynik badań eksperymentalnych z zastosowaniem wibrometrii laserowej.
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A new modelling arrangement for testing of Catenary Anchoring Leg Mooring (CALM) system behaviour in waves
PublicationW artykule przedstawiono układ modelowy pławy cumowniczo-przeładunkoweji łańcuchów kotwicznych możliwy do realizacji w wydłużonych basenach falowych służących na co dzień do badania właściwości morskich statków. System łańcuchów kotwicznych sprowadzono do płaszczyzn równoległych do osi basenu i połączono z pławą cienkimi linkami stalowymi przechodzącymi przez bloczki kierunkujące. Opisywany układ pozwolił na przeprowadzenie badań...
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Susceptibility of the LLC Resonance Generator for Induction Heating on Changes in Load Parameters Caused by Heating the Charge
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Injection of charge into the archetype organics hole transporting material TPD at the electrical contacts with ITO and Al
PublicationW pracy zaprezentowano dokładną analizę charakterystyk polowo-prądowych jednowarstwowych układów kwarc/ITO/TPD/Al oraz kwarc/Al1/TPD/Al2, zawierających próżniowo naparowane warstwy pochodnej diaminy (TPD) używane powszechnie jako materiał przewodzący dziury w organicznych diodach elektroluminescencyjnych. Prądy są zdominowane przez iniekcję dziur niezależnie od polaryzacji kontaktów elektrycznych. Oprócz oczywistej asymetrii w...
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Injection of charge into the archetype organic hole transporting material TPD at the electrical contacts with ITO and Al
PublicationW pracy opisano mechanizm przewodnictwa ciemnego w układzie ITO/warstwa TPD/Al oraz Al/warstwa TPD/Al, gdzie TPD oznacza dwaminę powszechne stosowaną jako transporter dziur w organicznych diodach EL.
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Influence of charge transfer state on Eu 3+ luminescence in LaAlO 3 , by high pressure spectroscopy
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