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Bi-based halide perovskites: Stability and opportunities in the photocatalytic approach for hydrogen evolution
PublikacjaIn this study, we successfully prepared Bi-based single perovskites of the A3Bi2I9 type (A = Cs, Rb, MA, FA), and, for the first time, attempted to experimentally obtain double perovskites Cs2B’BiI6 type (B′ = Ag, Au, In, Cu). Despite the premises available in theoretical studies, our research has proven the impossibility of the existence of double perovskites of this type. Nevertheless, both types of obtained materials were subjected...
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Structure versus hydrolytic and thermal stability of bio-based thermoplastic polyurethane elastomers composed of hard and soft building blocks with high content of green carbon
PublikacjaNowadays, sustainability plays a key role in the design and synthesis of new materials. One of the methods for the preparation of green materials is incorporation into their structure the monomers with a high content of green carbon. Therefore, the aim of this work was to investigate the influence of the type and molecular mass of two bio-based polyester polyols and bio-glycol on the properties of aliphatic partially bio-based...
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Production of certified reference materials - homogeneity and stability study based on the determination of total mercury and methylmercury
PublikacjaReference materials (RMs) play an important role in all elements of the quality assurance system of measurements. In this work, ``package'' 4 new CRMs (bottom sediment, herring tissue, cod tissue, cormorant tissue) were prepared and characterised to carry out the quality control in monitoring analysis of mercury and methylmercury in environmental samples. Materials - candidates were collected in Poland and south part of the Czech...
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Stability of softly switched multiregional dynamic output controllers with a static antiwindup filter: A discrete-time case
PublikacjaThis paper addresses the problem of model-based global stability analysis of discrete-time Takagi–Sugeno multiregional dynamic output controllers with static antiwindup filters. The presented analyses are reduced to the problem of a feasibility study of the Linear Matrix Inequalities (LMIs), derived based on Lyapunov stability theory. Two sets of LMIs are considered candidate derived from the classical common quadratic Lyapunov...
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Effect of different crystalline structures on W/O and O/W/O wax emulsion stability
PublikacjatThe possibility of emulsion stabilization using mineral and vegetable wax particles only (without sur-factant) was investigated. Mineral waxes, paraffin wax and ceresin, and a vegetable wax, carnauba wax,were used. The content of the wax particles and the water to oil proportion were found crucial for thestability of all emulsions. Some emulsions were also produced with a liquid wax (i.e. jojoba oil). Themultiple light scattering...
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Effect of Silicone on the Collagen Fibrillogenesis and Stability
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Investigation of stability of ester-urethane prepolymers
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Structural Dynamics and Stability of Composite Structures
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Vibrational properties and stability of FePt nanoalloys
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Model studies on then-alkane emulsions stability
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Stability of Superhalogen Anions in the Aqueous Phase
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Selected problems of stability of steel structures.
PublikacjaW pracy przedstawiono wyniki badań dotyczących stateczności wybranych konstrukcji stalowych. Prezentowane rozważania są oparte na klasycznych założeniach teorii prętów cienkościennych o nieodkształcalnym przekroju poprzecznym. Wyznaczono pierwszą wariację sił krytycznych pręta cienkościennego o bisymetrycznym otwartym przekroju poprzecznym uwzględniając następujące zmienne projektowe: ⎯wymiary przekroju poprzecznego, ⎯ charakterystyki...
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On the characteristic and stability of iron diet supplements
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Stability of the FDTD scheme containing macromodels.
PublikacjaZaprezentowano analizę stabilnościową algorytmu różnic skończonych w dziedzinie czasu zawierającego makromodele. Pokazano, że dla uzyskania stabilnych makromodeli stabilność schematu FDTD połączonego z makromodelami zależy od sposobu przeprowadzenia interpolacji pól granicznych. Maksymalny dozwolony krok czasowy jest dużo większy niż dla subgriddingu.
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Simplified stability analysis of steel cylindrical silos with corrugated walls and vertical columns
PublikacjaIn the paper a simplified stability analysis of steel cylindrical silos composed of corru¬gated walls and vertical open-sectional columns was proposed. The whole 3D silo was modeled as a single column resting on elastic foundation provided by the silo walls. In proposed formula for the calculation of the foundation stiffness the curvature of the silo walls was taken into account. Three different analyses were carried out using...
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A simplified approach to determine the expiration date of certified reference material based on the results of monitoring long-term stability
PublikacjaAll components of the quality assurance (QA) system for measurement results depend heavily on certified reference materials (CRMs). There is a need for a comprehensive discussion of the stability study using the CRM statistical method. Monitoring involves periodic sampling and analysis of the CRM at predetermined intervals to continuously monitor stability without compromising its integrity. The obtained stability data is then...
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Long-Term Stability of Benzodiazepines and Z-Hypnotic Drugs in Blood Samples Stored at Varying Temperatures
PublikacjaBenzodiazepines (BZDs) and Z-drugs are among the most commonly prescribed pharmaceuticals in the world and are considered standard care for various mental illnesses and for treatment of sleeping and anxiety disorders, alcohol withdrawal, muscle spasms and epilepsy. Some BZDs are not allowed as pharmaceuticals in many countries, and they are used as "designer benzodiazepines" (DBZDs). All these compounds are typically screened in...
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Cerclage cable augmentation does not increase stability of the fixation of intertrochanteric fractures. A biomechanical study
PublikacjaBackground: Intertrochanteric fractures with a posteromedial intermediate fragment are unstable because of the loss of medial support. Additional fixation with a cerclage is used in subtrochanteric fractures, but not in intertrochanteric fractures. The aim of this biomechanical study is to evaluate whether cerclage fixation improves stability of intertrochanteric fractures. Hypothesis: Our hypothesis is that the cerclage fixation...
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Energetic density of states in copper phthalocyanine studied by modulated photocurrent method
PublikacjaPrzy pomocy metody modulowanych fotoprądów określono różniczkowy i całkowy rozkład stanów pułapkowych w naparowanej ftalocyjaninie miedzi w koplanarnej konfiguracji elektrod próbki.
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Collective modes of the extended Hubbard model with negativeUand arbitrary electron density
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Influence of initial density of cohesionless soil on evolution of passive earth pressure
PublikacjaArtykuł porusza problem odporu bezkohezyjnego gruntu. Obliczenia wykonano wykorzystując metodę elementów skończonych na bazie mikropolarnego prawa hipolastycznego. W obliczeniach przyjęto różne początkowe zagęszczenia oraz średnice cząstek gruntu.
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Structure and elastic properties of Mg(OH)2from density functional theory
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Direct estimation of functional and density operators by local operations and classical communication.
PublikacjaWykazano, że można dokonywać detekcji splątania w paradygmacie odległych laboratoriów. Pokazano, jak można fizycznie zaimplementować strukturalne przybliżenie fizyczne niefizycznego odwzorowania w tym paradygmacie.
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Extended Newmark method to assess stability of slope under bidirectional seismic loading
PublikacjaThe paper concerns the dynamic behavior of a simple slope model subjected to simultaneous horizontal and vertical excitations. The proposed method is based on Newmark’s sliding block concept, however, four new features are introduced. The most important assumption is that the normal component of dynamic excitations affects the resisting force both before and after the initiation of the relative slope motion, making it time-dependent....
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Cascading transitions toward unconventional charge density wave states in the quasi-two-dimensional monophosphate tungsten bronze P4W16O56
PublikacjaSingle crystals of the m = 8 member of the low-dimensional monophosphate tungsten bronzes (PO2)4(WO3)2m family were grown by chemical vapour transport technique and the high crystalline quality obtained allowed a reinvestigation of the physical and structural properties. Resistivity measurements revealed three anomalies at TC1 = 258 K, TC2 = 245 K and TC3 = 140 K, never observed until now. Parallel X-ray diffraction investigations...
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Fine-Tuning the Photocatalytic Activity of the Anatase {1 0 1} Facet through Dopant-Controlled Reduction of the Spontaneously Present Donor State Density
PublikacjaThe present study highlights the importance of the net density of charge carriers at the ground state on photocatalytic activity of the faceted particles, which can be seen as a highly underexplored problem. To investigate it in detail, we have systematically doped {1 0 1} enclosed anatase nanoparticles with Gd3+ ions to manipulate the charge carrier concentration. Furthermore, control experiments using an analogical Nb5+ doped...
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Performance of extended Lagrangian schemes for molecular dynamics simulations with classical polarizable force fields and density functional theory
PublikacjaIterative 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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Stability and load bearing capacity of a braced truss under upward wind loading
PublikacjaThe paper is focused on the numerical and experimental investigation of stability of a steel truss under upward wind loading. The structure was stiffened by elastic braces situated at the top and bottom chord. Usually the lateral (translational) brace stiffness is considered. However, the rotational stiffness of braces caused by interaction between torsional stiffness of the truss top chord and bending stiffness of the roof elements...
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Stability and load bearing capacity of a braced truss under upward wind loading
PublikacjaThe paper is focused on the numerical and experimental investigation of stability of a steel truss under upward wind loading. The structure was stiffened by elastic braces situated at the top and bottom chord. Usually the lateral (translational) brace stiffness is considered. However, the rotational stiffness of braces caused by interaction between torsional stiffness of the truss top chord and bending stiffness of the roof elements...
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Towards evaluation of the Second Generation Intact Stability Criteria - examination of a fishing vessel vulnerability to surf-riding, based on historical capsizing
PublikacjaThe Second Generation Intact Stability Criteria (SGISC) are the latest achievements in the field of intact ship stability assessment. The criteria are the result of massive international cooperative efforts and extensive research that lasted more than 15 years. Even though they are based on a solid scientific foundation, the trial period has commenced to collect user experience and further validation. One of possible approaches...
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Electrostatic interactions in finite systems treated with periodic boundary conditions: Application to linear-scaling density functional theory
PublikacjaWe 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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Self-assembly, stability and conductance of amphotericin B channels: bridging the gap between structure and function
PublikacjaAmphotericin B (AmB), one of the most powerful but also toxic drugs used to treat systemic mycoses, is believed to selectively permeabilize fungal cell membranes to ions in a sterol-dependent manner. Unfortunately, the structure of the biologically active AmB channels has long eluded researchers, obstructing the design of safer alternatives. Here, we investigate the structural and thermodynamic aspects of channel formation, stability,...
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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.
PublikacjaThe 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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STILL ‘FEW, SLOW AND LOW’? ON THE FEMALE DIMENSION OF TECHNOLOGY, LABOUR MARKETS AND ECONOMIC ACTIVITY: EVIDENCE FOR THE PERIOD OF 1990-2017
PublikacjaThe known in empirical economics question ‘Why so Few? Why so Slow? Why so Low?’ refers here to the persistently small number of women involved in innovative activities, the slowness of change in the inequalities between women and men in these fields, and women’s continuing lower rank in business and academic positions. In developing countries, women`s labour and entrepreneurial activity remains an ‘untapped resource’ for economic...
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Density functional theory calculations on entire proteins for free energies of binding: Application to a model polar binding site
PublikacjaIn 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
PublikacjaIn 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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Chemical composition of water from roof in Gdańsk, Poland
PublikacjaThis study deals with the assessment of roof runoff waters from the region of Gdansk collected during the winter season (2007/2008). The chemical analysis includes 16 chemical variables: major ions, PAHs and PCBs measured at 3 sampling sites for 6-14 rain events. Although the data set is of limited volume the statistical data treatment using self-organizing maps (SOM) reveals the main factors controlling roof runoff water quality...
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Self-standing Nanoarchitectures
PublikacjaDespite there are structures invisible for the human eye, they mastered the world of advanced electronic devices, sensors, novel cosmetics or drugs. When the dimensions of the materials go down to the nanometres scale, their properties change dramatically comparing to the observable objects. Because of their tiny size, they gained the name of nanomaterials but simultaneously their importance has significantly grown up. Nanomaterials...
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Support Materials of Organic and Inorganic Origin as Platforms for Horseradish Peroxidase Immobilization: Comparison Study for High Stability and Activity Recovery
PublikacjaIn the presented study, a variety of hybrid and single nanomaterials of various origins were tested as novel platforms for horseradish peroxidase immobilization. A thorough characterization was performed to establish the suitability of the support materials for immobilization, as well as the activity and stability retention of the biocatalysts, which were analyzed and discussed. The physicochemical characterization of the obtained...
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Effect of bio-based components on the chemical structure, thermal stability and mechanical properties of green thermoplastic polyurethane elastomers
PublikacjaIt seems to be obvious that conditions changes during polyols synthesis have impact on the polyols properties. Even the chemical formula is the same or similar, physicochemical properties and also molecular weight of polyols might be different and are significant in term of future polyurethanes properties and processing. In this work, fully bio-based poly(propylene succinate)s synthesized at different temperature conditions were...
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Isotropic s -wave superconductivity in the noncentrosymmetric charge density wave superconductor SrPt2As2
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Noise spectral density computation based on finite element model of piezoceramic sensor
PublikacjaThe 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 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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Surface area investigation of materials with transition layers of continuously changing electron density
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The Effects of Cross-Link Density and Chemical Exchange on Magnetization Transfer in Polyacrylamide Gels
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The measurement of conformational stability of proteins adsorbed on siloxanes
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Comparison of oxidative stability of different edible oils
PublikacjaCelem prezentowanych badań było porównanie stabilności oksydacyjnej olejów roślinnych z Polski, Finlandii i Hiszpanii. Na etapie przyspieszania utleniania zastosowano promieniowanie ultrafioletowe (UV). Po naświetlaniu olejów powstałe związki lotne ekstrahowano z fazy nadpowierzchniowej za pomocą techniki mikroekstrakcji do fazy stacjonarnej (HS-SPME) i analizowano z zastosowaniem chromatografu gazowego z detektorem płomieniowo-jonizacyjnym...
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The Stability of 4‐Chloromethcathinone in Blood and Vitreous Humor
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Stability of trusses with linear elastic side-supports
PublikacjaThe present research is devoted to study of a lateral buckling of truss with linear elastic side supports. The elastic support reaction in relation to force in compressed chord and coefficient of buckling length related to side support distance are also calculated. The effect of slope of side support on limit force is also considered. The nonlinear analysis of two roof trusses are carried out. The results are compared to design...