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Search results for: THERMODYNAMICS
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Theoretical methods in thermodynamics of condensed phases
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The lows of thermodynamics: cell energy transfer
PublicationW pracy przedstawiono zasady termodynamiki i wymiany ciepła w organizmach żywych i urządzeniach technicznych. Przedstawiono zasady stosowania praw fizycznych związanych z konwersją energii w organizmach żywych.
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Singular Surface Curves in the Resultant Thermodynamics of Shells
PublicationWithin six-parameter shells theory we discuss the governing equations of shells with material or non-material singular curves. By singular curve we mean a surface curve where are discontinuities in some surface fields. As an example we consider shells with junctions and shells undergoing stress-induced phase transitions.
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Duhem and Natanson: Two Mathematical Approaches to Thermodynamics
PublicationIn this article, the previously unrecognized contributions of Pierre Duhem and Ladislavus Natanson in thermodynamics are shown. The mathematical remodelling of a few of their principal ideas is taken into consideration, despite being neglected in the literature. To emphasize these ideas in an appropriate epistemological order, it would be crucial to first revalue and reconstruct some underrepresented parts of the proceedings process...
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Chapter 7: Engineering Thermodynamics and the Carnot Cycle
PublicationThe chapter presents information about thermodynamics and thermodynamic cycles, especially the history and meaning of Carnot Cycle as well as P-v and T-s Diagrams
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1.21 Computation of Structure, Dynamics, and Thermodynamics of Proteins
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Thermodynamics of new piroxicam derivatives in terahertz light
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Thermodynamics of solid phases containing rare earth oxides
PublicationRare earth elements (RE) are incorporated into a large variety of complex oxide phases to provide tailored mechanical, electrical, optical, and magnetic properties. Thermodynamics control phase stability, materials compatibility in use, corrosion, and transformation. This review presents, in one compilation, the thermodynamic properties of a large number of such materials and discusses systematic trends in energetics and the factors...
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On coertia and inertia in aspects of Natanson’s nonlinear extended thermodynamics
PublicationIn this article, the previously underrepresented contributions of Natanson to the field of thermodynamics have been presented. In order to identify a source of irreversibility at Nature, Natanson introduced the concept of Coertia, which is similar to inertia. Natanson’s Coertia is a fundamental property of space that is responsible for every irreversible phenomena in matter, as well as in the electromagnetic and gravitational fields....
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Thermodynamics aspects of interactions between acridine derivatives and DNA
PublicationDNA is a molecular target for many anticancer and antiviral drugs. Therefore, a clear understanding of the interaction of small molecules with DNA is important in the rational design of ligands that can bind to DNA with high affinity and selectivity. There are several methods to investigate interactions between drug and DNA. Some of them measure changing into DNA structures, such as lengthening and untwisting of helix of DNA. Other...
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Thermodynamics of micellization of imidazolium ionic liquids in aqueous solutions
PublicationPodobieństwo pomiędzy strukturami niektórych cieczy jonowych, a surfaktamtami jonowymi wskazuje na możliwość wykazywania, przez te związki, tendencji do agregacji i adsorpcji na powierzchniach międzyfazowych. Mierząc w różnych temperaturach przewodnictwo elektryczne w funkcji stężenia oznaczono temperaturę Kraffta i zależność temperaturową krytycznego stężenia micelizacji (CMC) dla czterech, różniących się długościami łańcucha,...
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The laws of thermodynamics: entropy, free energy, information and complexity
PublicationW rozdziale przedstawiono podstawowe Zasady Termodynamiki. Omówiono zagadnienia związane z pojęciem entropii, energii Gibbsa, egzergii oraz systemami złożonymi.
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New Insights into Thermodynamics of Solutes in Neat and Complex Solvents
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Conductivity, structure, and thermodynamics of Y2Ti2O7–Y3NbO7 solid solutions
PublicationThe defect fluorite yttrium niobate Y3NbO7 and pyrochlore yttrium titanate Y2Ti2O7 solid solutions have been synthesized via a solid state synthesis route. The resulting stoichiometry of the oxides is Y2+xTi2−2xNbxO7, where x = 0 to x = 1. All of the samples were single-phase; however, for those with a predominant fluorite phase, a small amount of additional pyrochlore phase was detected. The volume of the solid solution unit cells...
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Numerical modelling of thermodynamics and dynamics of sea ice in the Baltic Sea
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Thermodynamics of the thermal decomposition of calcium oxalate monohydrate examined theoretically
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Neoclassical Navier–Stokes Equations Considering the Gyftopoulos–Beretta Exposition of Thermodynamics
PublicationThe seminal Navier-Stokes equations were stated even before the creation of the foundations of thermodynamics and its first and second laws. There is a widespread opinion in the literature on thermodynamic cycles that the Navier-Stokes equations cannot be taken as a thermodynamically correct model of a local "working fluid", which would be able to describe the conversion of "heating" into "working" (Carnot's type cycles) and vice...
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Thermodynamics of aggregation of 1-methyl-3-tetradecylimidazolium chloride in an aqueous solution
PublicationZbadano zależność agregacji chlorku 1-metylo-3-tetradecyloimidazoliowego w środowisku wodnym od temperatury. Wyznaczono krytyczne stężenie agregacji (CAC) oraz stopień jonizacji metodą pomiaru przewodnictwa właściwego. Otrzymane wyniki wykorzystano do predykcji parametrów termodynamicznych - entalpii swobodnej, entalpii i entropii, stosując phase separation model. Wykazano, że krzywa zależności CAC od temperatury jest U-kształtna...
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Irreversible thermodynamics model equations for heterogeneous solute flows in a double-membrane system
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Thermodynamics of Chemical Processes in the System of Nanocrystalline Iron–Ammonia–Hydrogen at 350 °C
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Removal of diphenols using pine biochar. Kinetics, equilibrium, thermodynamics, and mechanism of uptake
PublicationThermal pyrolysis synthesized activated biochar from the Pinus elliottii sawdust (PS) at 600° C. The obtained activated biochar (PB600) was used for the removal of three diphenols, catechol (CAT), resorcinol (RES), and hydroquinone (HYD), which are utilized mainly in different industries. The PB600 was characterized by several analytical techniques. The BET surface area of 1473 m2.g−1 and a total pore volume of 0.707 cm3 g−1 was...
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Thermodynamics, size, and dynamics of zwitterionic dodecylphosphocholine and anionic sodium dodecyl sulfate mixed micelles
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Thermodynamics and kinetics of amphotericin B self-association in aqueous solution characterized in molecular detail
PublicationAmphotericin B (AmB) is a potent but toxic drug commonly used to treat systemic mycoses. Its efficiency as a therapeutic agent depends on its ability to discriminate between mammalian and fungal cell membranes. The association of AmB monomers in an aqueous environment plays an important role in drug selectivity, as oligomers formed prior to membrane insertion – presumably dimers – are believed to act differently on fungal (ergosterol-rich)...
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UNRES server for physics-based coarse-grained simulations and prediction of protein structure, dynamics and thermodynamics
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Scale-consistent approach to the derivation of coarse-grained force fields for simulating structure, dynamics, and thermodynamics of biopolymers
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Adsorption of cationic dyes onto Fe@graphite core–shell magnetic nanocomposite: Equilibrium, kinetics and thermodynamics
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Thermodynamics and Intermolecular Interactions of Nicotinamide in Neat and Binary Solutions: Experimental Measurements and COSMO-RS Concentration Dependent Reactions Investigations
PublicationIn this study, the temperature-dependent solubility of nicotinamide (niacin) was measured in six neat solvents and five aqueous-organic binary mixtures (methanol, 1,4-dioxane, acetonitrile, DMSO and DMF). It was discovered that the selected set of organic solvents offer all sorts of solvent effects, including co-solvent, synergistic, and anti-solvent features, enabling flexible tuning of niacin solubility. In addition, differential...
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Function and Frustration of Multi-Drug ABC Exporter Protein and Design of Model Proteins for Drug Delivery Using Protein Hydration Thermodynamics
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Kinetics and thermodynamics of the reaction of iminodiacetate copper(II) complexes with 1,10-phenanthroline and 2,2′-bipyridine in aqueous, anionic, cationic and nonionic surfactants solutions
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Adsorption of anionic dye Direct Red 23 onto magnetic multi-walled carbon nanotubes-Fe3C nanocomposite: Kinetics, equilibrium and thermodynamics
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Multi-GPU-powered UNRES package for physics-based coarse-grained simulations of structure, dynamics, and thermodynamics of protein systems at biological size- and timescales
PublicationCoarse-grained models are nowadays extensively used in biomolecular simulations owing to the tremendous extension of size- and time-scale of simulations. The physics-based UNRES (UNited RESidue) model of proteins developed in our laboratory has only two interaction sites per amino-acid residue (united peptide groups and united side chains) and implicit solvent. However, owing to rigorous physics-based derivation, which enabled...
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Implementation of Molecular Dynamics and Its Extensions with the Coarse-Grained UNRES Force Field on Massively Parallel Systems: Toward Millisecond-Scale Simulations of Protein Structure, Dynamics, and Thermodynamics
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Computational fluid dynamics simulation of heat transfer from densely packed gold nanoparticles to isotropic media
PublicationThis work aims to determine and compare heat generation and propagation of densely packed gold nanoparticles (Au NPs) induced by a resonant laser beam (532 nm) according to the Mie theory. The heat flux propagation is transferred into the materials, which here are: silica glass; soda-lime-silica glass; borosilicate glass; polymethyl methacrylate (PMMA); polycarbonate (PC); and polydimetylosiloxane (PDMS). This analysis aims to...
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Challenges in operating and testing loop heat pipes in 500–700 K temperature ranges
PublicationThe potential applications of loop heat pipes (LHPs) are the nuclear power space systems, fuel cell thermal management systems, waste heat recovery systems, medium temperature electronic systems, medium temperature military systems, among others. Such applications usually operate in temperature ranges between 500–700 K, hence it is necessary to develop an LHP system that will meet this requirement. Such a thermal management device...
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Design and computational fluid dynamics analysis of the last stage of innovative gas-steam turbine
PublicationResearch regarding blade design and analysis of flow has been attracting interest for over a century. Meanwhile new concepts and design approaches were created and improved. Advancements in information technologies allowed to introduce computational fluid dynamics and computational flow mechanics. Currently a combination of mentioned methods is used for the design of turbine blades. These methods enabled us to improve flow efficiency...
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Cogenerative micro power plants - a new direction for development of power engineering?
PublicationW pracy przedstawiono rozważania dotyczące perspektywy mikrosiłowni domowych w gospodarce rozproszonej. Przedstawiono oryginalne kryterium doboru czynnika roboczego w mikrosiłowni oraz przedstawiono sprawności cieplne i egzergetyczne obiegów Clausiusa-Rankina realizujących pracę mikrosiłowni.
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A study of flow boiling heat transfer in minichannels
PublicationW pracy przedstawiono badania eksperymentalne wrzenia w przepływie w minikanale o średnicy wewnętrznej 2.3mm i długości 38cm. Uzyskano rozłady temperatury wzdłuż ścianki kanału oraz lokalne współczynniki przejmowania ciepła. Dane skorelowano z korelacją półempiryczną uzyskując zadowalającą zgodność.
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Determination of the thermal conductivity of material dividing the metallic core elements of the bi-calorimeter using modified theory
PublicationW pracy przedstawiono zmodyfikowaną teorię bikalorymetru z dzielonym metalowym rdzeniem. Pomiędzy dwiema częściami rdzenia umieszczano próbki badanego ciała stałego lub gazu. Ogrzewano jedną stronę rdzenia. Mierzono temperaturę obu części rdzenia w funkcji czasu. Uzyskane wyniki umożliwiły wyznaczenie różnicy temperatur i strumienia ciepła, przepływającego przez próbkę. Z zastosowaniem prawa Fouriera obliczano współczynnik przewodności...
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Improved model of void fraction distribution in two-phase flow in the boundary layer
PublicationPraca skupiona jest na eksperymentalnej weryfikacji sił działających na pęcherzyk gazowy przepływający wzdłuż ścianki kanału, a następnie implementacji uzyskanych wyników do zaproponowanego wczesniej przez jednego z współautorów modelu rozkładu stopnia zapełnienia w warstwie przyściennej przepływu dwufazowego. Podczas badań pęcherzyk modelowany był sztywną kulą podwieszoną na strunie. Autorzy przekonują, że pokazany model dobrze...
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A semi-empirical method for calculation of heat transfer coefficient in flow boiling for conventional tubes and minichannels
PublicationW pracy przedstawiono zagadnienia które należy uwzględnić podczas modelowania wymiany ciepła z wrzeniem w przepływie w kanałach o małej średnicy. Uzyskano dobrą zgodność z wynikami badań eksperymentalnych.
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Experiences from operation of different expansion devices for application in domestic micro CHP
PublicationW pracy opisano doświadczenia zdobyte podczas badań trzech różnych urządzeń ekspansyjnych, możliwych do zaimplementowania w mikrosiłowni CHP. Przebadano ekspander wykonany na bazie sprężarki spiralnej oraz dwojakiego rodzaju silniki pneumatyczne. Wykazano "wyższość" maszyn pneumatycznych nad ekspanderem typu scroll, uzyskując sprawności wewnętrzne w zakresie 61-82%. Dodatkowo, mniejsza objętość i masa urządzeń pneumatycznych stanowi...
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Model of heat transfer in the stagnation point of rapidly evaporating microjet
PublicationThe paper presents investigation into the single water microjet surface cooling producing evaporating film. Reported tests were conducted under steady state conditions. Experiments were conducted using the nozzle size of 70 and 100 mikrometer respectively. In the course of investigations obtained were experimental relations between heat flux and wall superheating. It was proved that the phenomenon is similar to that of pool boiling...
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Thermodynamic analysis of the double Brayton cycle with the use of oxy combustion and capture of CO2
PublicationIn this paper, thermodynamic analysis of a proposed innovative double Brayton cycle with the use of oxy combustion and capture of CO2, is presented. For that purpose, the computation flow mechanics (CFM) approach has been developed. The double Brayton cycle (DBC) consists of primary Brayton and secondary inverse Brayton cycle. Inversion means that the role of the compressor and the gas turbine is changed and firstly we have expansion...
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Power enhancement of the Brayton cycle by steam utilization
PublicationThe paper presents thermodynamic analysis of the gas-steam unit of the 65 MWe combined heat and power station. Numerical analyses of the station was performed for the nominal operation conditions determining the Brayton and combined cycle. Furthermore, steam utilization for the gas turbine propulsion in the Cheng cycle was analysed. In the considered modernization, steam generated in the heat recovery steam generator unit is directed...
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Comparative study of selected fluids for use in supercritical Organic Ranking Cycles
PublicationIn view of increasing interest in improving energy efficiency of energy conversion devices, there is an increasing requirement of combined production of heat and electricity as well as demand for increased implementation of renewable energy resources. The micro cogenerative units utilizing the Organic Rankine Cycle are focusing the attention of many research centres around the world. In the present paper calculations of ORC cycles...
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Dryout in annular flow - theoretical analysis
PublicationW pracy zaprezentowano model kryzysu wrzenia w przepływie pierścieniowym, obowiązujący dla wysokich wartości stopnia suchości i stanowiący modyfikację wcześniejszej wersji modelu zaproponowanego przez Sedlera i Mikielewicza. Model ten uwzględnia bilans masy w filmie cieczowym i bilans masy dla kropel cieczy w rdzeniu przepływu oraz zawiera dodatkowy człon odpowiedzialny za odparowanie filmu na ściance kanału. Rozwiązanie układu...
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Horizontal flow boiling of R22, R134a and their mixtures with oil in smooth and enhanced tubes
PublicationOpisano stanowisko i procedurę badawczą. Przedstawiono wyniki badań wrzenia czynników R 22 i R 134a oraz ich mieszanin z olejem wewnątrz dwóch rur gładkich i dwóch rur o rozwiniętej powierzchni. Zweryfikowno wybrane korelacje współczynnika przejmowania ciepła podczas wrzenia czystych czynników chłodniczych w rurach gładkich.
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The effect of temperature difference on heat transport in solar cells
PublicationW pracy omówiono wpływ wzrostu temperatury i mechanizm transportu ciepła na drodze przewodzenia w układach hybrydowych PV/T. Wyznaczono współczynniki przewodzenia krystalicznego krzemu typu n i p oraz gęstość strumienia ciepła w zakresie temperatur od 0 do 100 st. C.
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Formation of bubbles from a single nucleation site.
PublicationPrzedstawiono wyniki systematycznych badań eksperymentalnych wrzenia wody destylowanej i metanolu z pojedynczego, sztucznego centrum nukleacji. Jako centra nukleacji służyły otwory wywiercone na czołowej powierzchni miedzianego pręta. Średnice otworów wynosiły: 0.25 mm, 0.60 mm oraz 1.0 mm. Do pomiaru częstotliwości odrywania się pęcherzyków zastosowano układ laser diodowy-fotodioda. Sygnał z fotodiody był rejestrowany za...
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Modelling of heat transfer during flow condensation of natural refrigerants under conditions of increased saturation pressure
PublicationThe paper presents a modified in-house model for calculating heat transfer coefficients during flow condensation, which can be applied to a variety of working fluids, but natural refrigerants in particular, at full range thermodynamic parameters with a particular focus on increased saturation pressure. The modified model is based on a strong physical basis, namely the hypothesis of analogy between the heat transfer coefficient...