Search
Department of Solid State Physics
Publications
Filters
total: 997
Catalog Publications
Year 2014
-
237Np Mössbauer effect study on NpFeAsO
PublicationWe report 237Np Mössbauer measurements on NpFeAsO. The Np atoms were found to occupy only one crystallographic site. The value of the isomer shift (δ ∼ 9.1 mm s−1 versus NpAl2) indicates a 5f4 electronic configuration (Np3+ ions). The magnetic ordering of the Np sublattice below 60 K is established and the saturated ordered magnetic moment is determined to be 1.73μB at 3.6 K. The unique set of hyperfine parameters exclude a modulated...
-
Aggregation of Rhodamine 6G in titanium dioxide nanolayers and bulk xerogels
PublicationNanolayers and bulk xerogels of Rhodamine 6G (Rh6G) in titanium dioxide (Rh6G/TiO2) were prepared using the sol–gel method. The spectroscopic and structural properties of these two types of hybrid matrices were studied as a function of dye concentration. In both cases absorption, fluorescence and time resolved emission spectra show the formation of fluorescent aggregates. The observed stronger changes in characteristics of bulk...
Year 2015
-
3D porous graphene-based structures- synthesis and applications
PublicationPorous carbon-based materials are of the great industrial and academic interest due to their high surface area, low density, good electrical conductivity, chemical inertness and low cost of fabrication. Up to now, the main approach to obtain porous carbon structures has involved the pyrolysis of carbonaceous natural or synthetic precursors. After the isolation of graphene, the interest in 3D porous graphene-based structures (called...
-
A large family of filled skutterudites stabilized by electron count
PublicationThe Zintl concept is important in solid-state chemistry to explain how some compounds that combine electropositive and main group elements can be stable at formulas that at their simplest level do not make any sense. The electronegative elements in such compounds form a polyatomic electron-accepting molecule inside the solid, a ‘polyanion’, that fills its available energy states with electrons from the electropositive elements...
-
Absence of superconductivity in fluorine-doped neptunium pnictide NpFeAsO
PublicationX-ray diffraction, specific heat, magnetic susceptibility and inelastic x-ray scattering measurements on the transurarium oxypnictides NpFeAsO and NpFeAsO0.85F0.15 are presented. No superconductivity down to 2 K was observed upon fluorine doping, contrary to the structurally analogous rare-earth pnictides. No modification of the phonon density of states was observed upon doping with fluorine. We discuss our results in light of...
-
Anharmonic Infrared Spectroscopy through the Fourier Transform of Time Correlation Function Formalism in ONETEP
PublicationDensity functional theory molecular dynamics (DFT-MD) provides an efficient framework for accurately computing several types of spectra. The major benefit of DFTMD approaches lies in the ability to naturally take into account the effects of temperature and anharmonicity, without having to introduce any ad hoc or a posteriori corrections. Consequently, computational spectroscopy based on DFT-MD approaches plays a pivotal role in...
-
ANODOWE WARSTWY KATALITYCZNE DLA TLENKOWYCH OGNIW PALIWOWYCH ZASILANYCH BIOGAZEM
PublicationW pracy wytworzono materiały (LiLaNi-Al2O3) oraz (Sm0.2Ce0.8O1.9), jako potencjalne katalizatory reakcji reformingu biogazu w tlenkowych ogniwach paliwowych. Syntezę przeprowadzono metodą Pechini’ego. Zbadano skład chemiczny oraz strukturę uzyskanych związków. Ponadto ogniwo sprawdzono podczas pracy z biogazem pod kątem odporności na osadzenie węgla, a także wpływu na długość pracy ogniwa.
Year 2003
-
A Comparison between MD and EXAFS extracted Structural Data for TernaryRbBr(1-x)Ix.
PublicationStrukturę trójskładnikowych soli poddano analizie za pomocą metody EXAFS i symulacji M-D. Przedyskutowano przydatność używanego w symulacjach potencjału oddziaływań międzyatomowych.
-
A resistivity peak close to Tc in Nd2-xCexCuO4-y single crystals.
PublicationW pracy dyskutowane jest maximum oporu elektrycznego występujące tuż powyżej temperatury przejścia nadprzewodzącego. Maksimum jest obserwowane tylko przy jednej z dwóch możliwych konfiguracji pomiarowych w metodzie van der Pauw.Proponowany, na bazie niejednorodności składu ceru, prosty model wyjaśnia w pełni pochodzenie efektu.
Year 2020
-
A comprehensive evaluation of flexible FDM/FFF 3D printing filament as a potential material in medical application
PublicationThe use of FDM/FFF in 3D printing for medical sciences is becoming common. This is due to the high availability and decent price of both 3D printers and filaments useful for FDM/FFF. Currently, researchers' attention is focused mainly on the study of medical filaments based on PLA, PCL or their modifications. This contributes to insufficient diversity of medical-grade filaments on the market. Moreover, due to the lack of specified...
-
A Flexible Nafion Coated Enzyme‐free Glucose Sensor Based on Au‐dimpled Ti Structures
PublicationThe detection of glucose at low concentrations using electrochemical sensors is of great importance due to the possibility of using different human body fluids than blood, such as e.g. urine, saliva, sweat or tears. The interest behind those biofluids is related to their utility in non-invasive sugar determination. In this work, we present flexible, fully biocompatible electrode material based on Au nanoparticles immobilized onto...
-
A study of the kinetics of bismuth telluride synthesis by an oxide reduction method
PublicationThe kinetics of a reduction of bismuth and tellurium oxides in a hydrogen atmosphere, leading to the formation of thermoelectric bismuth telluride is investigated. The evaluation of the reaction kinetics was based on a thermogravimetric analysis performed in non-isothermal conditions. A non-parametric analysis method and the Friedman method were used for the evaluation of the data. Additionally, for a better understanding of the...
-
Antimony substituted lanthanum orthoniobate proton conductor – structure and electronic properties.
PublicationX‐ray and neutron diffraction have been utilized to analyze the crystalline and electronic structure of lanthanum orthoniobate substituted by antimony. Using X‐ray absorption spectroscopy and photoelectron spectroscopy, changes in the electronic structure of the material upon substitution have been analyzed. The structural transition temperature between fergusonite and scheelite phases for 30 mol% antimony substitution was found...
Year 2018
-
A Family of Pb-based Superconductors with Variable Cubic to Hexagonal Packing
PublicationWe describe three previously unreported superconductors, BaPb3, Ba0.89Sr0.11Pb3, and Ba0.5Sr0.5Pb3. These three materials, together with SrPb3, form a distinctive isoelectronic family of intermetallic superconductors based on the stacking of Pb planes, with crystal structures that display a hexagonal to cubic perovskite-like progression, as rarely seen in metals. The superconducting transition temperatures (Tc) are similar for...
-
A method of determination of electrical conduction mechanisms in complex amorphous materials
PublicationA novel approach to determine conduction mechanisms in complex amorphous materials was presented and tested on a real system. In the first step of the presented method, total electrical admittance of the material is analyzed in order to separate a couple of processes, each of which can be described by Jonscher's universal dielectric response. In the following step, a temperature dependence of dielectric response parameters of the...
-
A study of a reduction of a micro- and nanometric bismuth oxide in hydrogen atmosphere
PublicationA reduction of bismuth oxide in hydrogen atmosphere was investigated. The reaction was performed with a material in various structural forms: powder: with micrometric grains, powder with nanometric grains and powder pressed into pellets. The process was performed in both isothermal and non-isothermal conditions. An activation energy of the reaction calculated with Friedman method was found to be about 85 kJ/mol for the reduction...
-
Application of the Barkhausen effect probe with adjustable m agnetic field direction for stress state determination in the P91 ste el pipe
PublicationThe paper presents the results of application of a novel Barkhausen effect (BE) probe with adjustable magnetizing field direction for the stress level evaluation in ferromagnetic materials. The investigated sample was in a form of a pipe, made of P91 steel that was anisotropic due to the production process. The measurements were performed before and after welding, revealing the influence of welding process on the residual stress...
-
Au–Si plasmonic platforms: synthesis, structure and FDTD simulations
PublicationPlasmonic platforms based on Au nanostructures have been successfully synthesized by directional solidification of a eutectic from Au and the substrate. In order to determine homogeneous shape and space distribution, the influence of annealing conditions and the initial thickness of the Au film on the nanostructures was analyzed. For the surface morphology studies, SEM and AFM measurements were performed. The structure of platforms...
Year 2017
-
A fast procedure of stress state evaluation in magnetically anisotropic steels with the help of a probe with adjustable magnetizing field direction
PublicationThe paper presents a novel approach to the stress state evaluation issue. It deals with a strongly (magnetically) anisotropic materials for which a direct interpretation of the Barkhausen effect (BE) intensity would lead to erroneous results. In such a case one has to take into account both the measured BE intensity and the orientation of the magnetisation direction relative to the magnetic easy axis. For the in plane stress distribution...
-
A tetragonal polymorph of SrMn2P2 made under high pressure – theory and experiment in harmony
PublicationFollowing the predictions of total energy calculations, a tetragonal SrMn2P2 phase is proposed and successfully formed under high pressure. At ambient pressure, SrMn2P2 adopts the primitive trigonal La2O3 structure type (space group P[3 with combining macron]m1). However, the results of total energy calculations indicate that SrMn2P2 should be more stable in the tetragonal ThCr2Si2 structure type (space group I4/mmm) than in its...
Year 2016
-
A highly-efficient technique for evaluating bond-orientational order parameters
PublicationWe propose a novel, highly-efficient approach for the evaluation of bond-orientational order parameters (BOPs). Our approach exploits the properties of spherical harmonics and Wigner 3jj-symbols to reduce the number of terms in the expressions for BOPs, and employs simultaneous interpolation of normalised associated Legendre polynomials and trigonometric functions to dramatically reduce the total number of arithmetic operations....
-
ADAPTATION OF ENGINEERING FEA-BASED ALGORITHMS TO LCF FAILURE AND MATERIAL DATA PREDICTION IN OFFSHORE DESIGN
PublicationThere is an ever growing industrial demand for quantitative assessment of fatigue endurance of critical structural details. Although FEA-based calculations have become a standard in engineering design, problems involving the Low-To-Medium cycle range (101-104) remain challenging. This paper presents an attempt to optimally choose material data, meshing density and other algorithm settings in the context of recent design of the...
-
Advanced Potential Energy Surfaces for Molecular Simulation
PublicationAdvanced potential energy surfaces are defined as theoretical models that explicitly include many-body effects that transcend the standard fixed-charge, pairwise-additive paradigm typically used in molecular simulation. However, several factors relating to their software implementation have precluded their widespread use in condensed-phase simulations: the computational cost of the theoretical models, a paucity of approximate models...
Year 2002
-
A Molecular dynamics study of the influence of chemical reduction on the structure of amorphous germania
PublicationPraca poświęcona jest badaniom struktury blisko- i średniozasięgowej redukowanego amorficznego tlenku germanu o składzie 1Ge 1GeO2 za pomocą symulacji dynamiczno-molekularnych. Symulacje MD realizowano w zespole mikrokanonicznym (NVE), z wykorzystaniem dwuciałowego potencjału oddziaływania miedzyatomowego Borna-Mayera-Hugginsa. Wyraźnie widoczna tendencja do aglomeracji neutralnych atomów Ge została porównana z tendencją do aglomeracji...
-
Analysis of the interfacial energy of GaAs-Si hetrostructures
PublicationPrzeprowadzono obliczenia numeryczne energii powierzchni heterogranicy GaAs-Si z zastosowaniem półempirycznego modelu czteroparametrycznego Acklanda. Pokazano zależność energii heterogranicy od orientacji podłoża Si. Minima energetyczne otrzymano dla orientacji Si równych (011), (133), (112) i (113) co wskazuje ich zastosowanie do epitaksjalnego wzrostu warstw GaAs.
Year 2019
-
A negative effect of carbon phase on specific capacity of electrode material consisted of nanosized bismuth vanadate embedded in carbonaceous matrix
PublicationLithium-ion batteries (LIBs) are widely used all over the world. The LIBs belong to a renewable energy source and energy storage devices. The increase in energy demand causes that new materials of higher energy and higher power densities are still under investigation. Herein, we compare electrochemical properties of bismuth vanadate (BiVO4) embedded and not embedded into carbonaceous matrix as an anode material along with structural...
-
A new simple approach to prepare rare-earth metals-modified TiO2 nanotube arrays photoactive under visible light: Surface properties and mechanism investigation
PublicationApplication of Ti90RE10 alloys (RE = Ho, Er, Nd, Y, Ce, Tm) as a working electrode, instead of Ti pure foil in anodic oxidation in a fluoride-based electrolyte, resulted in formation of well-ordered nanotubes made of TiO2 and RE2O3 mixture, which could be efficiently used for pollutant removal from water and air phase upon UV and visible irradiation and easily separable from the reaction mixture to recycle. The as-prepared NTs...
-
Amyloid fibril formation in the presence of water structure-affecting solutes
PublicationThe impact of the differently hydrated non-electrolytes (protein structure destabilizers) on the fibrillation of hen egg white lysozyme (HEWL) was investigated. Two isomeric urea derivatives i.e. butylurea (BU) and N,N,N′,N′-tetramethylurea (TMU) were chosen as a tested compounds. The obtained results show that butylurea exerts greater impact on HEWL and its fibrillation than tetramethylurea. Both substances decrease the time of...
-
Analysis of the possibility of creep damage detection in T24 heat resistant steel with the help of magnetic nondestestructive testing methods
PublicationThe paper presents the result of an analysis of applicability of various electromagnetic methods of nondestructive evaluation for creep damage detection in a novel heat resistant steel - T24 grade. Two sample sets, cut out from membrane wall tubes, were investigated – the as-delivered one and another exploited for 36,000 h in a power plant. There are described results of magnetic hysteresis loops B(H), Barkhausen noise (BN) and...
-
Anisotropic mechanical behavior and auxeticity of penta-graphene: Molecular statics/molecular dynamics studies
PublicationWe investigate the mechanical properties of penta-graphene (PG), a recently proposed two-dimensional carbon allotrope using atomistic simulation techniques combined with the empirical description of interatomic interactions. We report on the dependence of its three in-plane mechanical moduli (i.e. Young's modulus, Poisson's ratio and shear modulus) on the deformation direction, strain and temperature. We show that PG displays a...
Year 2012
-
A role of destructive and non-destructive tests in creep damage Identification
PublicationPrzedstawiono wyniki badań mjących zilustrować i określić rolę badań niszczących i nieniszczących w identyfikowaniu degradacji po pełzaniu
-
Application of mechanical Barkhausen noise in assessment of X20 steel properties after heat treatment
Publication -
Assessment with mechanical Barkhausen effect of residual stress in grain oriented polycrystalline 3% Si-Fe sheet
PublicationZbadano za pomocą mechanicznego efektu Barkhausena poziom napręzeń wewnętrznych w plikrystalicznej płycie z 3% Si-Fe o zorientowanym ziarnie.
-
Auxetic foams
PublicationThis paper presents a method of producing auxetic polyurethane foams (PUFs) and their unique properties. The experience was based on a synthesis of traditional flexible polyurethane foam and thermal conversion to auxetic foam. The foam specimens were transformed from conventional Poisson's ratio to auxetic (negative Poisson's ratio) [1]. Basic research was performed to determine the mechanical properties and cell structure. Auxetic...
Year 2009
-
A XAS study of a highly diluted Pt electrocatalyst operating in PEM fuel cells
PublicationWe present an X-ray absorption spectroscopy (XAS) study of a low Pt content catalyst layer(Pt loading 0.1 mg c2) operating at the cathode of a proton exchange membrane fuel cell(PEMFC). This catalyst is based on the use of a mesoporous inorganic matrix as a support forthe catalyst Pt nanoparticles. Due to the high Pt dilution, in situ measurements of itsstructural properties by XAS are challenging and suitable experimental strategies...
-
Ab initio Structure Determination of Mg10Ir19B16
PublicationOkreślono strukturę krystalograficzną nowego, nie-centrosymetrycznego nadprzewodzącego związku chemicznego, mg10ir19b16. Została zastosowana cała gama technik eksperymentalnych: dyfrakcja elektronowa, proszkowa dyfrakcja promieniowania rentgenowskiego, mikroskopia elektronowa wysokiej rozdzielczości, itd. Określenie struktury krystalograficznej było skrajnie trudne ponieważ jest to nowy, nieznany dotąd typ struktury krystalicznej,...
-
Applications of spin coating of polymer precursor and slurrysuspensions for Solid Oxide Fuel Cell fabrication
PublicationW pracy przedstawiono możliwości zastosowania w tlenkowych ogniwach paliwowych metody nanoszenia wirowego prekursorów polimerowych i zawiesin. Przedstawiono przykłady zastosowania tej metody do wytworzenia elektrolitu oraz warstw ochronnych dla stali nierdzewnych.
Year 2010
-
Ac and dc conductivities in v2o5-p2o5 glasses containing alkaline ions
PublicationWe investigated the ac and dc conductivity in 50V2O5-(50 − x)P2O5-xA2O (A = Li, Na, K) glasses as a function of temperature. The measurements were carried out in the frequency range from 10−4 to 107 Hz. For all compositions, the dc conductivity decreased with the increasing alkali ion content. The decrease in conductivity was more pronounced for larger alkali ions. The ac conductivity exhibited a universal dynamic response: σac...
-
Antistatic properties of nanofilled coatings
Publicationpraca podsumowuje wyniki badań właściwości antystatycznych powłok polimerowych domieszkowanych nanocząsteczkami srebra oraz sio2. właściwości antystatyczne określano poprzez badanie czasu rozpraszania ładunku zgromadzonego po wyładowaniu koronowym.
Year 2011
-
Acceptor doping of barium cerate
Publication -
Assessment with mechanical Barkhausen effect of residual stress in grain oriented polycrystalline 3% Si-Fe sheet
PublicationW tym artykule zostały opisane badania naprężeń resztkowych w blachach wykonanych z 3% si-fe o zorientowanym ziarnie za pomocą mechanicznego efektu barkhausena (mebn). badano blachy o 3 różnych orientacjach ziaren względem głównej osi próbki: 0, 45, 90 stopni. badania mebn przeprowadzano wzbudzając drgania skrętne oraz drgania gięte. zmierzone maksima obwiedni napięcia skutecznego mebn znajdują się dla badanych próbek w regionie...
Year 2007
-
Advanced XAS analysis for investigating fuel cell electrocatalysts
PublicationW pracy została zaprezentowana analiza XAFS nanocząstek platyny używanych jako materiał katalityczny w niskotemperaturowych ogniwach paliwowych. Analiza danych EXAFS została przeprowadzona za pomocą zaawansowanej metody GNXAS, w której wzięto pod uwagę rozkład rozmiaru granul nano-platyny i niejednorodność warstwy katalitycznej elektrody, badane za pomocą SEM (skaningowy mikroskop elektronowy), TEM (transmisyjny mikroskop elektronowy)...
-
Analiza namagnesowania w badaniach technicznych materiałów ferromagnetycznych
PublicationDo elektromagnetycznych metod badań nieniszczących stali należą m.in. polowy efekt Barkhausena (HBN) oraz emisja magnetoakustyczna (EMA). Pełne zrozumienie i optymalizacja wspomnianych technik wymaga scharakteryzowania zależności między czasoprzestrzennym stanem namagnesowania obiektu a mierzonymi wielkościami fizycznymi. Potrzebne jest podjęcie badań nad ilościowym opisem stanu namagnesowania materiałów ferrytycznych dla przypadku...
Year 2008
-
An EXAFS study of the local structure of rare-earth luminescence centres in the Ca3Ga2Ge3O12 glass
PublicationW pracy przedstawiono wyniki analizy EXAFS danych mierzonych na krawędzi L3 atomów ziem rzadkich takich jak Eu, Ho (0.7 wt.%) oraz Er (1.46 wt.%), którymi domieszkowano szkło 3CaO-Ga2O3-3GeO2. Otrzymane parametry strukturalne opisujące pierwszą powłokę koordynacyjną badanych atomów wskazują, że ich lokalne otoczenie tlenkowe jest jednakowe (niezależne od typu jonu ziemi rzadkiej) i uwzględniając strukturalny nieporządek bardzo...
-
An in-depth study of the Barkhausen emission signal properties of the plastically deformed Fe-2%Si alloy
PublicationZbadana została korelacja między natężeniem emisji magnetoakustycznej a natężeniem mechanicznego efektu Barkhausena dla próbek ze stali P91 mających różną mikrostrukturę na skutek plastycznego płynięcia w temperaturze pokojowej lub na skutek przyspieszonego pełzania w temperaturze 773K pod naprężeniem 290 KPa. Zakres deformacji plastycznej dla pierwszego zestawu próbek wynosił od 2% do 10,5% a dla drugiego od 0,85% do 10%. Oba...
Year 2006
-
Analysis of mixing rules for the Stillinger-Weber potential: a case study of Ge-Si interactions in the liquid phase
PublicationCiekły stop Ge_{0.25}Si_{0.75} symulowano metodą dynamiki molekularnej, przy użyciu potencjału Stillingera-Webera. Badano wpływ parametryzacji członu potencjału odpowiedzialnego za oddziaływania trójciałowe w trójkach nieidentycznych atomów na strukturę symulowanego stopu. Wpływ ten okazał się być znaczący.Zmiany w parametrach rzędu kilku procent skutkowały istotnymi różnicami w parowych funkcjach rozkładu, kątowych funkcjach rozkładu...
-
Atomic substitution and carbon isotope effect in superconducting MgCNi3
PublicationW pracy analizowany jest wpływ domieszkowania zarówno pozycji niklu, jak i węgla w nadprzewodzącym związku międzymetalicznym MgCNi3. Dodatkowo dyskutowany jest węglowy nadprzewodzący efekt izotopowy.
Year 2021
-
Application of Artificial Neural Networks to Predict Insulation Properties of Lightweight Concrete
PublicationPredicting the properties of concrete before its design and application process allows for refining and optimizing its composition. However, the properties of lightweight concrete are much harder to predict than those of normal weight concrete, especially if the forecast concerns the insulating properties of concrete with artificial lightweight aggregate (LWA). It is possible to use porous aggregates and precisely modify the composition...
Year 2013
-
Application of wet powder spraying for anode supported solid oxide fuel cell with a perowskite SrTi0.98Nb0.02O3-d anode
PublicationAnode-supported solid oxide fuel cell with SrTi0.98Nb0.02O3–d anode, yttria-stabilized zirconia electrolyte and La(Ni0.6Fe0.4) O3d cathode has been successfully fabricated and evaluated. Process of anode support fabrication has been presented. Wet powder spraying and high temperature sintering method have been studied and applied to deposit the thin electrolyte layer.In order to improve catalytic properties of the anode, it has...
-
Auksetyczne pianki poliuretanowe
PublicationPrzedmiotem badań były auksetyczne pianki poliuretanowe wytworzone metodą trójosiowej termo-kompresji z konwencjonalnych elastycznych pianek poliuretanowych. Materiały auksetyczne charak-teryzują się ujemnym współczynnikiem Poissona i dzięki swojej strukturze komórkowej charakteryzują się unikalnymi właściwościami fizyko-mechanicznymi. Zbadano wpływ trójosiowej termokompresji na zmianę właściwości mechanicznych oraz struktury otrzymanej...