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Search results for: EXPERIMENTAL SPECTRA
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Application of higher order spectra in harmonic analysis of corrosion process
PublicationZjawiska nieliniowe są niezwykle często spotykane w praktyce badań elektrochemicznych i korozyjnych. Typowym przykładem są procesy elektrodowe kontrolowane szybkością przeniesienia ładunku. Często stosowanym w takich przypadkach podejściem jest aproksymacja fragmentu krzywej prąd-napięcie za pomocą charakterystyki liniowej. W niniejszej pracy autorzy prezentują możliwość wykorzystania pomiarów składowych harmonicznych do oceny...
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Collision-induced luminescence spectra of pyridine bombarded by 1000 eV He+ cations
PublicationHere we show collision-induced luminescence spectra measured for collisions of the He+cations with thearomatic six-membered ring of the pyridine molecule (C5H5N). Distinct emission bands due to the CH(A2Δ→X2Πr;B2Σ+→X2Πr;C2Σ+→X2Πr), CN(B2Σ+→X2Σ+), C2(d3Πg→a3Πu), and NH(A3Π→X3Σ−) transitions, aswell as atomic H, He, and C lines have been observed. Apart from the He atoms, all the emitters arise from thefragmentation of the pyridine...
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Time evolution of Electrochemical Impedance spectra of cathodically protected steel in artificial seawater
PublicationUsability of Electrochemical Impedance Spectroscopy data for better cathodic protection control was investigated. Carbon steel – S235JR2 grade specimen were exposed in artificial seawater environment. Samples were polarized and their potentials corresponded to four different cathodic protection degrees. Time evolution of Electrochemical Impedance spectra was investigated. Goodness of fit function (X2) was analysed in terms of proper...
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Luminescence Spectra of β-SiAlON/Pr3+ Under High Hydrostatic Pressure
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High pressure and time resolved luminescence spectra of Gd3Ga5O12:Pr3+ crystal
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High pressure luminescence spectra of CaMoO4:Ln3+(Ln = Pr, Tb)
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Mixture Model Based Efficient Method for Magnetic Resonance Spectra Quantification
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Analyze of Maldi-TOF Proteomic Spectra with Usage of Mixture of Gaussian Distributions
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Threshold photoelectron spectra of tetrahydrofuran over the energy range 9-29eV
PublicationWykonano pomiary fotoelektronowe widm progowych tetrahydrofuranu C4H8O w zakresie energii fotonów 9-29 eV przy użyciu promieniowania synchrotronowego. Zaobserwowano nowe pasma jonizacyjne w zakresie energii 16-26eV
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Theoretical interpretations of photoelectron spectra of platinum atom, its cation and anion
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Relativistic calculations of X-ray photoelectron spectra and the accuracy of the IOTC method*
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TL, OSL and RL emission spectra of RE-doped LiMgPO4 crystals
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STUDY OF CuO AND V2O5 EFFECT ON IR SPECTRA OF POLYCRYSTALLINE BISMUTH NIOBATE
PublicationBismuth niobate (BiNbO4) ceramics were fabricated by mixed oxide method and sintered by presureless sintering method. BiNbO4 ceramics doped with V2O5 additive in amount 0.125 wt%, 0.250 wt% and 1 wt% of was sintered at T = 910°C whereas BiNbO4 ceramics doped with 2 wt% of CuO additive was sintered at T = 890°C and T = 910°C. It was found that V2O5 additive improved morphology of the ceramic samples. However, the chemical composition...
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Investigation of Weigh-in-Motion Measurement Accuracy on the Basis of Steering Axle Load Spectra
PublicationWeigh-in-motion systems are installed in pavements or on bridges to identify and reduce the number of overloaded vehicles and minimise their adverse eect on road infrastructure. Moreover, the collected trac data are used to obtain axle load characteristics, which are very useful in road infrastructure design. Practical application of data from weigh-in-motion has become more common recently, which calls for adequate attention to...
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Übertragung von Anregungsenergie in Dreikomponentenlösungen
PublicationA general dependence between directly measured fluorescence spectra of three-component solutions and the spectra of the individual components was specified. In the considerations, radiative and non-radiative energy transfer processes were taken into account, including energy migration and the possibility of inactive transfer. The obtained dependence was verified using two solution systems as examples and in both cases a good...
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Surface Plasmon-Coupled Emission of Rhodamine 110 Aggregates in a Silica Nanolayer
PublicationFirst analysis of strong directional surface plasmon-coupled emission(SPCE) of ground-state formed intermolecular aggregates of Rhodamine 110 (R110) insilica nanofilms deposited on silver nanolayers is reported. Until now, the processes ofenergy transport and its trapping due to aggregate formation have not been studied in the presence of SPCE. A new approach to multicomponent systems with weakly and strongly fluorescent centers...
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Impedance Spectra of RC Model as a Result of Testing Pulse Excitation Measurement Method Dataset
PublicationThe dataset titled Impedance spectra of RC model as a result of testing pulse excitation measurement method contains the impedance spectrum of an exemplary test RC model obtained using pulse excitation. The dataset allows presentation of the accuracy of the impedance spectroscopy measuring instrument, which uses the pulse excitation method to shorten the time of the whole spectrum acquisition.
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Low energy electron mass stopping power in H2
PublicationWe present experimental mass stopping powers of electrons in gaseous H2 obtained with a newly developed electron time-of-flight spectrometer, for the incident electron energy range of 10eV to 25eV. In our procedure the average energy loss is derived from our conversion of measured electron time-of-flight spectra into equivalent electron energy loss spectra so as to obtain the values of mass stopping power for electron scattering...
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Vibrational Sum-Frequency Generation Activity of a 2,4-Dinitrophenyl Phospholipid Hybrid Bilayer: Retrieving Orientational Parameters from a DFT Analysis of Experimental Data
PublicationThe vibrational nonlinear activity of films of 2,4-dinitrophenyl phospholipid (DNP) at the solid interface is measured by sum-frequency generation spectroscopy (SFG). Hybrid bilayers are formed by a LangmuirSchaefer approach in which the lipid layer is physisorbed on top of a self-assembled monolayer of dodecanethiol on Pt with the polar heads pointing out from the surface. The SFG response is investigated in two vibrational frequency...
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Theory of valence-band and core-level photoemission from plutonium dioxide
PublicationThe correlated-band theory implemented as a combination of the local-density approximation with the dynamical mean-field theory is applied to PuO2. An insulating electronic structure, consistent with the experimental valence-band photoemission spectra, is obtained. The calculations yield a nonmagnetic ground state that is characterized by a noninteger filling of the plutonium 5f shell. The noninteger filling as well as the satellites...
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Interactions in Ternary Aqueous Solutions of NMA and Osmolytes—PARAFAC Decomposition of FTIR Spectra Series
PublicationIntermolecular interactions in aqueous solutions are crucial for virtually all processes in living cells. ATR-FTIR spectroscopy is a technique that allows changes caused by many types of such interactions to be registered; however, binary solutions are sometimes difficult to solve in these terms, while ternary solutions are even more difficult. Here, we present a method of data pretreatment that facilitates the use of the Parallel...
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Novel Investigation of Higher Order Spectral Technologies for Fault Diagnosis of Motor-Based Rotating Machinery
PublicationIn the last decade, research centered around the fault diagnosis of rotating machinery using non-contact techniques has been significantly on the rise. For the first time worldwide, innovative techniques for the diagnosis of rotating machinery, based on electrical motors, including generic, nonlinear, higher-order cross-correlations of spectral moduli of the third and fourth order (CCSM3 and CCSM4, respectively), have been comprehensively...
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Cylindrical surface irregularities presented by frequency spectra of relative tool displacement to the workpiece
PublicationW pracy przedstawiono częstotliwościowe składowe nierówności powierzchni toczonych. Ponieważ nierówności mają charakter szerokopasmowy, trudny do wartościowania parametrami normatywnymi, zastosowano ich analizę amplitudowo-częstotliwościową, opartą na szybkiej transformacie Fouriera. Zaproponowano oryginalny układ pomiaru sygnału przemieszczeń narzędzia względem przedmiotu dla charakteryzowania nierówności wzdłużnych. Dla generowania...
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Temperature effect on the emission spectra of narrow band Mn4+phosphors for application in LEDs
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Comparison of Algorithms for Profile-Based Alignment of Low Resolution MALDI-ToF Spectra
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Cylindrical surface irregularities presented by frequency spectra of relative tool displacement to the workpiece
PublicationW pracy przedstawiono częstotliwościowe składowe nierówności powierzchni toczonych. Ponieważ nierówności mają charakter szerokopasmowy, trudny do wartościowania parametrami normatywnymi, zastosowano ich analizę amplitudowo-częstotliwościową, opartą na szybkiej transformacie Fouriera. Zaproponowano oryginalny układ pomiaru sygnału przemieszczeń narzędzia względem przedmiotu dla charakteryzowania nierówności wzdłużnych. Dla generowania...
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Structure of Kα1,2 - and Kβ1,3 -emission x-ray spectra for Se, Y, and Zr
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Hydration of Simple Carboxylic Acids from Infrared Spectra of HDOand Theoretical Calculations
PublicationBadanie hydratacji kwasów karboksylowych w rozcieńczonych roztworach wodnych ma duże znaczenie dla zrozumienia ich funkcji biologicznych. Metodą stosowaną w badaniach była spektroskopia oscylacyjna FTIR z zastosowaniem techniki rozcieńczenia izotopowego wody półciężkiej HDO w roztworze wody zwykłej. Do analizy danych widmowych wykorzystano ''metodę widm różnicowych''. Widma HDO zaburzonej przez kwasy: mrówkowy, octowy i propionowy...
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Higher-order spectra for harmonics detection in nonlinear systems at presence of Gaussian noise.
PublicationPrzedstawiono metodę wykrywania harmonicznych w ukladach nieliniowych za pomocą funkcji bispektrum. Przebadano skuteczność proponowanej metody w porównaniu z metodą wykorzystującą gęstość widmową mocy. Badania przeprowadzono dla sygnałów będących sumą sygnału harmonicznego i realizacji szumu białego.
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Multispectral impedance quality testing of coil-coating system using principal component analysis
PublicationThe task of quality checking of the coil-coated system was undertaken using impedance spectroscopy. In order to properly characterize the system the new impedance spectrum was calculated as an averaged result of 12 experimental spectra obtained from 12 different places of the sample at the same time of immersion in 3% of NaCl. The experimental spectra were recorded for a 24-h period at 1 h intervals between starting points of each...
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Yields and Time-of-Flight Spectra of Neutral High-Rydberg Fragments at the K Edges of the CO2 Molecule
PublicationWe have studied the production of neutral fragments in high-Rydberg (HR) states at the C 1s and O 1s edges of the CO2 molecule by performing two kinds of experiments. First, the yields of neutral HR fragments were measured indirectly by ionizing such fragments in a static electric field and by collecting resulting singly charged positive ions as a function of the photon energy. Such measurements reveal not only excitations below...
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High pressure and time-resolved luminescence spectra of Ca3Y2(SiO4)3doped with Eu2+and Eu3+
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Initial Stages of Angiosperm Greening Monitored by Low-Temperature Fluorescence Spectra and Fluorescence Lifetimes
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On the interpretation of high-resolution x-ray spectra from JET with an ITER-like wall
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Conformation Properties, Chiroptical Spectra, and Molecular Self-Assembly of 2,3-Piperazinodiones and Their Dithiono Analogues
PublicationRodzina chiralnych cyklicznych oksamidów została otrzymana przez kondensację optycznie czynnych 1,2-diamin ze szczawianem dietylu. Tionowanie produktów odczynnikiem Lawessona doprowadziło do chiralnych 2,3-dipiperazynodionów. Geometrie cząsteczkowe badano z użyciem obliczeń kwantowo-mechanicznych DFT i porównano z wynikami analizy krystalograficznej. Sześcioczłonowy pierścień heterocykliczny przyjmuje konformację półkrzesłową,...
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Shaping the SPL Spectra of the Acoustic Noise Emitted by Inverter-Fed Indu- ction Motors
PublicationW artykule przedstawiono nowe podejście do zmniejszania wpływu właściwości mechanicznych maszyny na emitowany przez nią hałas akustyczny. Dokonano identyfikacji mechanicznych rezonansów maszyny wykorzystując modulację RPWM z losowym wyborem częstotliwości nośnej oraz modulację sigma delta, dla której otrzymano relatywnie płaskie widmo prądu. Skonstruowano na tej podstawie funkcję gęstości prawdopodobieństwa wyboru częstotliwości...
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A study of the photoelectron spectra of α-tetrahydrofurfuryl alcohol over the outer valence energy region (9–25 eV)
PublicationPhotoelectron spectra of α-tetrahydrofurfuryl alcohol (THFA) molecules, the threshold spectrum and spectra for constant photoelectron energies, have been measured over the photon energy range 9–25 eV. Analysis of the photoelectron spectra has allowed overlapping photoionization bands to be separated, tentatively assigned and their vertical photoionization energies to be determined. These energies are compared with existing theoretical...
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Radiative lifetime of a BODIPY dye as calculated by TDDFT and EOM-CCSD methods: solvent and vibronic effects
PublicationThe radiative emission lifetime and associated S1 excited state properties of a BODIPY dye are investigated with TDDFT and EOM-CCSD calculations. The effects of a solvent are described with the polarizable continuum model using the linear response (LR) approach as well as state-specific methods. The Franck–Condon (FC), Herzberg–Teller (HT) and Duschinsky vibronic effects are evaluated for the absorption and emission spectra, and...
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Anomalous diffraction approach to the visible spectra of absorption by marine particles with power-law size distributions
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Modelling of the soft X-ray tungsten spectra expected to be registered by GEM detection system for WEST
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Structure of high-resolution Kβ1,3 x-ray emission spectra for the elements from Ca to Ge
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Absolute Configuration Determination by Quantum Mechanical Calculation of Chiroptical Spectra: Basics and Applications to Fungal Metabolites
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ATR FT-IR H2O spectra of acidic aqueous solutions. Insights about proton hydration
PublicationW artykule podjęto próbę ilościowej analizy widm oscylacyjnych H2O w wodnych roztworach kwasów. Widma H2O dostarczają głównie informacji o stanie strukturalnym cząsteczek wody, wynikającym ze sprzężeń oscylatorów w układzie. Są jednak znacznie trudniejsze w interpretacji niż widma HDO. Widma wodnych roztworów kwasów jednoprotonowych (HCl, HClO4, HPF6) zmierzono posługując się spektroskopią FT-IR w technice osłabionego wewnętrznego...
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Validity of impedance spectra obtained by dynamic electrochemical impedance spectroscopy verified by Kramers-Kronig transformation.
PublicationArtykuł przedstawia weryfikację wiarygodności widm impedancyjnych otrzymanych za pomocą niedawno wprowadzonej techniki eksperymentalnej - Dynamicznej Elektrochemicznej Spektroskopii Impedancyjnej (Dynamic Electrochemical Impedance Spectroscopy, DEIS). Technika ta zakłada, że badany system jest pseudostacjonarny jeśli czas pomiaru jest odpowiednio krótki. Czas potrzebny na otrzymanie pojedynczego spektrum zależy od długości okna...
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Planar chiral dianthranilide and dithiodianthranilide molecules: optical resolution, chiroptical spectra, and molecular self-assembly.
PublicationChiralny planarnie diantranilid został rozdzielony na enancjomery przy użyciu chlorku (-)-(1S,4R)-kamfanoilu. Konfigurację absolutną (S)-enancjomeru ustalono na podstawie analizy rentgenograficznej monokryształu jego N,N'-dikamfoilopochodnej. Natomiast rozdział ditiodiantranilidu na enancjomery przeprowadzono poprzez tworzenie związków inkluzyjnych z (R,R)-1,2-diaminocykloheksanem. Otrzymanemu w ten sposób enancjomerowi przypisano...
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Ionic hydration in LiPF6, NaPF6, and KPF6 aqueous solutions derived from infrared HDO spectra.
PublicationZbadano hydratację LiPF6, NaPF6 oraz KPF6 przy pomocy metody FTIR, z zastosowaniem techniki rozcieńczenia izotopowego HDO w H2O. Dane widmowe poddano analizie metodą ważonych widm różnicowych. Główne wnioski pracy stanowią uzupełnienie i rozszerzenie pasmowego modelu hydratacji kationów, wcześniej postulowanego na podstawie widm w podczerwieni HDO wodnych roztworów różnych elektrolitów.
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Bonding in Phosphanylphosphinidene Complexes of Transition Metals and their Correlation with Structures, 31 P NMR Spectra, and Reactivities
PublicationTheoretical studies of the bonding interactions and most important properties are carried out for isolable phosphanylphosphinidene complexes of transition metals. Three main types of phosphanylphosphinidene complexes are distinguished, based on the way in which the phosphanylphosphinidene ligand bonds to the metal center: (i) side-on complexes of platinum, where the R2Pβ–Pα ligand mimics structural features of free singlet phosphanylphosphinidenes...
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Influence of silver-core gold-shell nanoparticle parameters on the variation of surface-enhanced Raman spectra
PublicationThe detection of molecules by surface-enhanced Raman spectroscopy (SERS) is dependent on the nanomaterial used to induce the enhancement effect. This depends on a variety of parameters of the substrate such as the metal used for their creation, their shape, size and size distribution, concentration, as well as the parameters of the solution, such as packing of the nanoparticles, the complexity of the sample, the solvent, etc. It...
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Tuning of the plasmon resonance location in Au nanostructures coated with a ultrathin film of Al2O3 – Optical measurements and FDTD simulations
PublicationThe Au nanostructures have been coated with an ultra-thin films of amorphous aluminium oxide. Optical absorption spectra show the influence of the thickness of Al2O3 on plasmon resonance wavelength. The observed red-shift of the resonance location with the increase of the thickness of the Al2O3 film, can be explained by the change in the dielectric function of this film. It allows control of the optical spectra of the coated particles....
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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...