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Pre-selection and assessment of green organic solvents by clustering chemometric tools
PublicationThe study presents the result of the application of chemometric tools for selection of physicochemical parameters of solvents for predicting missing variables – bioconcentration factors, water-octanol and octanol-air partitioning constants. EPI Suite software was successfully applied to predict missing values for solvents commonly considered as “green”. Values for logBCF, logKOW and logKOA were modelled for 43 rather nonpolar solvents...
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Efficiency of exciton splitting in organic photovoltaic cells within EQE spectrum
PublicationThe paper presents a procedure of estimating the efficiency of exciton splitting at ED/EA interface. The procedure consists in evaluation of splitting of excitons into electron-hole pairs on the basis of the external quantum efficiency spectra of planar cells and spectra of absorbance of active organic layers. The fitting parameters are the exciton splitting probabilities at ED/EA interface. The presented procedure was applied...
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Solvothermal synthesis and structural characterization of three polyoxotitanium-organic acid clusters
PublicationThree new titanium oxo-clusters Ti4O2(OiPr)10(OOCPhMe)2 (I), Ti6O4(OEt)8(OOCPhMe)8 (II) and Ti6O6(OEt)6(OOCCHPh2)6 (III) were obtained by easy one-step solvothermal reactions of titanium(IV) isopropoxide, alcohols and carboxylic acids. The three compounds were characterized by single-crystal and powder X-ray diffraction, TGA/DSC, optical and electron microscopy, and FTIR and NMR spectroscopy. X-ray powder diffraction and spectroscopy...
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Surface and Trapping Energies as Predictors for the Photocatalytic Degradation of Aromatic Organic Pollutants
PublicationIn this study, anatase samples enclosed by the majority of three different crystal facets {0 0 1}, {1 0 0}, and {1 0 1} were successfully synthesized. These materials were further studied toward photocatalytic degradation of phenol and toluene as model organic pollutants in water and gas phases. The obtained results were analyzed concerning their surface structure, reaction type, and surface development. Moreover, the regression...
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Metal-organic frameworks (MOF) based heat transfer: A comprehensive review
PublicationHigher than a standard level, the humidity provides a suitable environment for the pathogenic microorganisms to grow and increases energy consumption for cooling, increasing greenhouse gas emissions. Desiccant air-conditioning (DAC) is an effective method to reduce humidity and energy simultaneously. Conventional desiccants are not suitable for use as a desiccant in building air conditioners, mainly because of high regeneration...
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The Use of Organic Coagulants in the Primary Precipitation Process at Wastewater Treatment Plants
PublicationMeasurements for determining the effect of chemically enhanced primary treatment (CEPT) on the efficiency of pollutant removal from wastewater were carried out using conventional inorganic coagulants PIX113 with polymer A110 (Kemipol, Police, Poland) and unconventional cationic organic coagulants Cofloc (Attana, Coalville, UK) C29510 (Kemipol, Police, Poland) and Sedifloc 575 (3F Chimica, Sandrigo, Italy). The average removal efficiency...
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Precipitation and Transformation of Vaterite Calcium Carbonate in the Presence of Some Organic Solvents
PublicationIn this paper, the production of CaCO3 particles via the carbonation route in the reaction of CaCl2 and CO2, using NH3 as a promoter of CO2 absorption, was studied. The solvents used as the reaction media for CaCO3 precipitation were aqueous solutions of methanol, isopropanol and dimethyl sulfoxide (DMSO), in a concentration range of 0–20% (v/v). It was found that the presence of an organic additive influenced the precipitation...
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Phosphorus concentration and availability in raw organic waste and post fermentation products
PublicationThe aim of the study was to determine the mobility of phosphorus forms in raw organic waste and from the solid and liquid fractions of digestate. To achieve the purpose of this study, the components (including livestock manure, agricultural waste, food waste, sewage sludge) and their post fermentation products were considered. Subsequently, the effect of the fermentation process on the mobility of phosphorus forms in post-fermentation fractions...
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Calculating the Partition Coefficients of Organic Solvents in Octanol/Water and Octanol/Air
PublicationPartition coefficients define how a solute is distributed between two immiscible phases at equilibrium. The experimental estimation of partition coefficients in a complex system can be an expensive, difficult, and time-consuming process. Here a computational strategy to predict the distributions of a set of solutes in two relevant phase equilibria is presented. The octanol/water and octanol/air partition coefficients are predicted...
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Calibration of the Chemcatcher passive sampler for the monitoring of priority organic pollutants in water
PublicationNa Univeristy of Portsmouth (UK) opracowano próbnik pasywny typu Chemcatcher, który może być stosowany do długotrwałego monitoringu organicznych zanieczyszczeń wody. Na działanie wszystkich próbników pasywnych wpływ mają warunki środowiskowe takie jak np. ruch wody czy temperatura. Przed użyciem próbnika Chemcatcher w badaniach polowych wymagana więc była wcześniejsza kalibracja w laboratorium. Przedstawiono wyniki serii doświadczeń...
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Grzegorz Boczkaj dr hab. inż.
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Model hybrydowy układu wielowirnikowego z przekładnią
PublicationW pracy przedstawiono metodę redukcji modelu układu wielowirnikowego z przekładnią, w którym uwzględniono zmienną prędkość kątową wirników, oddziaływania żyroskopowe, nieproporcjonalne tłumienie oraz nieliniowość podatności zazębienia. Zaproponowano hybrydową metodę modelowania, w której zastosowano: dekompozycję modalną oraz dyskretyzację przestrzenną. Zredukowany model modalny zbudowano dla części rozważanego układu, w której...
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Influence of excitons interaction with charge carriers on photovoltaic parameters in organic solar cells
PublicationWe report on theoretical analysis of excitons annihilation on charge carriers in organic solar cells. Numerical calculations based on transient one-dimensional drift-diffusion model have been carried out. An impact of three quantities (an annihilation rate constant, an exciton mobility and a recombination reduction factor) on current density and concentrations of charge carriers and excitons is investigated. Finally, we discuss...
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Expectation-Maximization Model for Substitution of Missing Values Characterizing Greenness of Organic Solvents
PublicationOrganic solvents are ubiquitous in chemical laboratories and the Green Chemistry trend forces their detailed assessments in terms of greenness. Unfortunately, some of them are not fully characterized, especially in terms of toxicological endpoints that are time consuming and expensive to be determined. Missing values in the datasets are serious obstacles, as they prevent the full greenness characterization of chemicals. A featured...
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Four-body recombination in organic bulk heterojunction solar cells: an alternative interpretation
PublicationWe demonstrate a new interpretation of the previously reported quadrimolecular recombination in organic bulk heterojunction solar cells. It is suggested that the recently described (Szmytkowski 2012 Phys. Status Solidi RRL 6 300) interaction between exciton and electron–hole Langevin bound pair formed across the donor–acceptor interface is a four-particle process. This is in opposition to the treatment of this effect as a three-particle...
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Modification of current-voltage characteristics of planar organic systems by nm-thick interlayer
PublicationEffect of nm-thick interlayer of copper phthalocyanine (CuPc) or perylene dye (MePTCDI) on current-voltage characteristics of planar organic systems is discussed in the work. The MePTCDI layer strongly limits injection of holes from ITO into CuPc, while CuPc limits injection of electrons from ITO into MePTCDI. In the systems with CuPc/MePTCDI heterojunction an explicit photovoltaic effect occurs.
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Interlayer defect evolution in an organic coating system on steel under hydromechanical loading
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Stratification of particulate organic carbon and nitrogen in the Gdańsk Deep (Southern Baltic Sea)
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Influence of dissolved organic matter in natural and simulated water on the photochemical decomposition of butylparaben
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Water uptake in protective organic coatings and its reflection in measured coating impedance
PublicationWater uptake in commercially available epoxy coating on mild steel using impedance spectroscopy and gravimetry was studied. The water content in the coating was determined using the Brasher-Kingsbury equation and various methods of coating capacitance calculation used in the literature. The obtained results were compared with reference gravimetric data. An overestimation of values obtained from impedance data in relation to gravimetric...
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Miniaturized Passive Emission Chambers for In Situ Measurement of Emissions of Volatile Organic Compounds
PublicationThe results of many different studies have demonstrated unequivocally that the quality of indoor air is often much worse than that of atmospheric air. The presence of dangerous chemical compounds in indoor air can have an adverse impact on human health and cause numerous diseases of the respiratory and circulatory systems. Such harmful chemicals get into indoor air as a result of their emission from building and indoor materials....
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Modeling of Transient Photocurrent in Organic Semiconductors Incorporating the Annihilation of Excitons on Charge Carriers
PublicationThe role of the annihilation of excitons on charge carriers has been theoretically investigated in organic semiconductors. We have developed the numerical drift-diffusion model by incorporation terms which describe the annihilation process. The transient photocurrent has been calculated for different injection barrier heights, exciton mobilities, and annihilation rate constants. We have demonstrated that the annihilation has a...
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Problems and challenges associated with estimating the emissions of organic compounds from indoor materials
PublicationFor several years intensive research has been carried out with the aim of developing a database of the types and amounts of pollutants released from indoor materials to the indoor environment. The paper discusses in detail basic problems and challenges encountered when estimating the emissions of chemical compounds released from of indoor materials. Factors affecting the validity of data obtained by using two different types of...
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Determination of Toxicological Parameters of Selected Bioactive Organic Chemicals Using the Ostracodtoxkit FTM
PublicationAssessment of the impact of pharmaceutical residues on living organisms is very complex subject. Apart from taking into account the toxicity of individual compounds also their presence in mixtures should be taken into account. In this work, attempts were made to assess the ecotoxicity of biologically active substances (with 50 % effective concentration (EC50) values growing from fluoxetine (EC50 = 4.431 nM) >> gemfibrozil ≈ 17α-ethinylestradiol...
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Adsorption from aqueous solutions of chlorinated organic compounds onto activated carbons
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Organic micropollutants paracetamol and ibuprofen—toxicity, biodegradation, and genetic background of their utilization by bacteria
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Determination of the chemical structure of potential organic impurities occurring in drug substance opipramol
PublicationThe tricyclic antipsychotic and antidepressant drug opipramol (opipramole) was examined with regard to the chemical structure of its organic impurities. Impurities were isolated from the technical product by chromatographic methods and their chemical structures were established by 1H NMR, MS and FTIR and further confirmed by comparison with commercially available products or with products obtained by independent synthesis, and...
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The effectiveness of organic matter removal in unit processes of the technological groundwater treatment system
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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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Removal of organic compounds from water by solvent sublation. Criteria for solvent selection.
PublicationProces flotoekstrakcji zastosowano do usuwania z wody następujących związków organicznych: tetrachlorku węgla, chloroformu, 1,3,5-trimetylobenzenu (mezytylenu), fenolu i 2,4,5-trichlorofenolu. Jako odbierające fazy organiczne użyto: olej mineralny, 1-dekanol, 1-oktanol, octan amylu, dodekan i tetradekan. Mechanizmem decydującym o usuwaniu lotnych związków organicznych (VOC) było odparowanie do wnętrza pęcherzyków gazu, podczas...
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Theoretical Organic Rankine Cycle efficiency depending on different thermodynamic work variables.
PublicationOne of promising technologies of utilizing low- temperature waste heat is through ORC (Organic Rankine Cycle) system implementation. A primary objective in designing in-stallations based on such systems is to maximize the installation's work efficiency. On the other hand, ecological factors are commonly considered a natural barrier in introducing new, often very expensive technologies. Ecological effect of a potential modernization...
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Particulate organic carbon in the southern Baltic Sea: numerical simulations and experimental data
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Characteristics of volatile organic compounds emission profiles from hot road bitumens
PublicationA procedure for the investigation and comparison of volatile organic compounds (VOCs) emission profiles to the atmosphere from road bitumens with various degrees of oxidation is proposed. The procedure makes use of headspace analysis and gas chromatography with universal as well as selective detection, including gas chromatography–mass spectrometry (GC–MS). The studies revealed that so-called vacuum residue, which is the main component...
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A Review on Metal–Organic Framework as a Promising Catalyst for Biodiesel Production ENERGY & FUELS
PublicationThe rapid depletion of fossil-derived fuels along with rising environmental pollution have motivated academics and manufacturers to pursue more environmentally friendly and sustainable energy options in today’s globe. Biodiesel has developed as an ecologically favorable alternative. However, the mass manufacturing of biodiesel on an industrial scale confronts substantial cost and pricing challenges. To address this issue, high-efficiency...
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Exposure to cooking emitted volatile organic compounds with recirculating and extracting ventilation solutions
PublicationEnergy-efficient urban development leads to the compact design of apartments. Recirculating ventilation solutions are an attempt to minimize the space required for ventilation ducting, but more data on their performance are needed. Cooking is a major source of volatile organic compounds (VOCs) emissions. It is necessary to assess how well recirculating kitchen hoods perform in reducing the residents' exposure to cooking fumes compared...
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Donor properties of water in organic solvents derived from infrared spectraof HDO
PublicationPrzedyskutowano niektóre ilościowe aspekty kooperatywności wiązań wodorowych wody. Zaproponowano skalę własności elektronodonorowych wody w środowisku aprotycznych rozpuszczalników organicznych, pochodną w stosunku do skali liczb donorowych Gutmanna.
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Unlocking the Secrets of River Pollution: Analyzing Organic Pollutants in Sediments—Experimental Study
PublicationUntreated wastewater released into rivers can result in water pollution, the spread of waterborne diseases, harm to ecosystems, contamination of soil and groundwater, as well as air pollution and respiratory problems for nearby humans and animals due to the release of greenhouse gases. The current study aims to investigate the recent input of anthropogenic loads into the rivers using linear alkylbenzene (LAB), which is one of the...
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Removal of hydrophobic organic pollutants from soil by surfactants and biosurfactants solution flushing
PublicationPrzedstawiono wyniki solubilizacji dwóch związków hydrofobowych - tetrachloroetylenu i dodekanu oraz dwóch bazowych olejów mineralnych - SAE 30/95 i PAO6 w wodnych roztworach syntetycznych związków powierzchniowo czynnych oraz biosurfaktantów. Zaobserwowano liniowy wzrost solubilizacji wraz ze wzrostem stężenia surfaktantu.Przedstawiono także wyniki wymywania oleju PAO6 ze sztucznie zaolejonego piasku (w kolumnie) z pomocą roztworów...
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Electroabsorption in triphenylamine-based hole-transporting materials for organic light-emitting diodes
PublicationMetodą elektroabsorpcji (EA) badano stany wzbudzenia elektronowego w próżniowo naparowanych warstwach diamin (TPD, TAPC) i dendrymeru aminowego m-MTDATA. Widma EA amin złożonych porównano z widmem monomeru trifenylaminy (TPA). Kształt widm EA świadczy o obecności zdegenerowanych i quasi-zdegenerowanych stanów elektronowych.
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Influence of COD-fractions on removal effectiveness and accumulation of organic matter in constructed wetlands
PublicationW pracy wykazano, że efektywność usuwania substancji organicznej doprowadzanej w ściekach bytowo-gospodarczych do złóż hydrofitowych zależy od rodzaju frakcji substancji organicznej oraz ich stężeń. Na podstawie analizy poszczególnych frakcji ChZT (rozpuszczonych związków organicznych biologicznie łatwo- i nierozkładalnych oraz zawiesin organicznych biologicznie wolno- i nierozkładalnych) wykazano, że na akumulację substancji organicznej...
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Organic-inorganic composites consisted of poly(3,4-ethylenedioxythiophene)and Prussian Blue analogues
PublicationThe organic-inorganic material consisted of poly(3,4-ethylenedioxythiophene) (pEDOT) and copper hexacyanoferrate (Cuhcf) was synthesized. The pEDOT film with Fe(CN)63−/4− as counter-ions potentiodynamically polarized in aqueous CuCl2 electrolyte brings about stable hybrid material (pEDOT/Cuhcf) performing single redox activity of FeII/III at a formal potential Ef = 0.61 V (vs. Ag/AgCl/0.1 M KCl) and less clearly shaped two redox...
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Determination of the chemical structure of potencial organic impurities occuring in the drug substance opopramol
PublicationThe tricyclic antipsychotic and antidepressant drug opipramol was examined with regard to the chemical structure of its organic impurities. Impurities were isolated from the technical product by chromatographic methods and their chemical structures were estabilished by HMNR, MS and FTIR.
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Organic-inorganic materials for fast charging-discharging processes in energy storage devices
PublicationPraca dotyczy materiału kompozytowego złożonego z poli(3,4-etylenodioksytiofenu) i heksacyjanokobaltanu żelaza. Materiał został otrzymany elektrochemicznie bezpośrednio na elektrodzie tytanowej metodą jednoetapowa z zawiesiny zawierającej monomer (EDOT) oraz Fe3[Co(CN)6]2 w postaci proszku. Warstwy pEDOT/FehcCo otrzymane potencjostatycznie ładunkiem od 0,6 do 1,5 C/cm2 charakteryzują się różną grubością (od 1,9 do 4 μm) zależną...
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Working fluid selection for Organic Rankine Cycle applied to heat recovery systems
PublicationPrzedstawiono algorytm obliczeń sprawności systemu ORC na bazie dużej liczby cieczy organicznych.
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Volatile organic compound separation from gas phase using ionic liquids
PublicationZanieczyszczenie powietrza lotnymi związkami organicznymi staje się światowym problemem ochrony środowiska w związku z ich toksycznymi właściwościami. W związku z tym poszukuje się nowych, efektywnych technologii oczyszczania strumieni gazowych. Powszechnie stosowaną metodą jest utlenianie termiczne. Wiąże się ono jednak z Wysokiem zużyciem energii i efektami ubocznymi w postaci emisji dwutlenku węgla i tlenków azotu. Alternatywą...
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Organic Pollution in Surface Waters from the Fuglebekken Basin in Svalbard, Norwegian Arctic
PublicationThe Fuglebekken basin is situated in the southern part of the island of Spitsbergen (Norwegian Arctic), on the Hornsund fjord (Wedel Jarlsberg Land). Surface water was collected from 24 tributaries (B1-B24) and from the main stream water in the Fuglebekken basin (25) between 10 July 2009 and 30 July 2009. The present investigation reveals the results of the analysis of these samples for their PAH and PCB content. Twelve of 16 PAHs...
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Dependence between quality and removal effectiveness of organic matter in hybrid constructed wetlands
PublicationW procesie oczyszczania ścieków w Vertical Flow Constructed Wetland (VF-CW) jednym z czynników jest dopływ tlenu. Niewystarczający dopływ tlenu do złoża może być przyczyną braku efektywności usuwania zanieczyszczeń, a więc wskazywać na niewłaściwą eksploatację obiektu.Obiekty badań stanowiły złoża pionowe stanowiące jeden z elementów biologicznego oczyszczania dwóch hybrydowych systemów hydrofitowych zlokalizowanych w Wieszynie...
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On doubts about Mott-Schottky plot of organic planar heterojunction in photovoltaic cell
PublicationNa wykresie Motta-Schottky'ego przedstawione są wyniki pomiarów przeprowadzonych na komórkach fotowoltaicznych z planarnym heterozłączem organicznym. W pracy pokazano, że fotowoltaiczne układy z planarnym heterozłączem organicznym, podobnie jak planarne złącza półprzewodnikowe, mogą prowadzić do liniowych charakterystyk na wykresie Motta-Schottky'ego. Pokazano jednak, że parametry uzyskane z analizy otrzymanych prostych nie mogą...
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On the light intensity dependence of short-circuit current of bilayer organic photovoltaic cells
PublicationPraca przedstawia model zależności prądu zwarcia w organicznych dwuwarstwowych układach fotowoltaicznych od natężenia światła. Model jest oparty na założeniu jednorodnego pola elektrycznego w obu warstwach organicznych. Uwzględniona jest bimolekularna i monomolekularna rekombinacja nośników ładunku przy heterozłączu. Przedstawione zostało porównanie obliczeń teoretycznych i wyników doświadczalnych dla układów z barwnikiem perylenowym...
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Organic and conventional kiwifruit myths versus reality: antioxidant, antiproliferative and health effects
PublicationComparison between organic and conventional kiwifruit cultivars ''Hayward'' and ''Bidan'', which was done by four redical scavenging assays, ESI-MS, and DSC measurements, showed significant differences between cultivars. Such results were not estimated in kiwifruit growing under organic and conventional conditions. The extraction of bioactive compounds was done by two different methods: sequential extraction with ethyl acetate...