1. GasesAlojz Kodre, Iztok Arčon, Jana Padežnik Gomilšek, 2024, znanstveni sestavek v slovarju, enciklopediji, leksikonu Opis: X-ray absorption spectroscopy of gases is seldom used for structural analysis,
except in as much as the extended X-ray absorption fine-structure (EXAFS)
signal is used to monitor some specific molecular process. Gas spectroscopy,
however, has been the main tool in the systematic study of higher-order
photoabsorption processes, multielectron photoexcitations (MEEs), which were
introduced with an experiment at the K edge of argon. Along with noble gases,
where MEEs are studied in the pure form, free of the structural signal,
measurements have been extended to monatomic metal vapours, although at the
cost of considerable experimental difficulties. Several types of absorption cells
have been devised, among them the ceramic double cell and the heat-pipe cell
for experiments in the low-energy region. In a high-temperature oven with
considerable technical refinement, edge profiles of nonvolatile metals were
measured up to 2500 K. Edge profiles and MEEs, which are strongly dependent
on electron correlation, provide sensitive tests of the theory of atomic and
molecular structure. Ključne besede: X-ray absorption spectroscopy, absorption cells, gas and vapour samples, multielectron photoexcitation, effects of electron
correlation Objavljeno v RUNG: 05.09.2024; Ogledov: 614; Prenosov: 4 Povezava na datoteko Gradivo ima več datotek! Več... |
2. Monitoring chemical processes in (photo)catalysts and energy storage materials by operando X-ray absorption spectroscopyIztok Arčon, 2022, objavljeni povzetek znanstvenega prispevka na konferenci (vabljeno predavanje) Opis: X-ray absorption spectroscopy (XAS) is a powerful tool for characterisation of local structure and chemical state of selected elements in different new functional materials and biological or environmental samples. The XAS spectroscopy is based on extremely bright synchrotron radiation X-rays sources, which allow precise characterisation of bulk, nanostructured or highly diluted samples. The rapid development of extremely bright synchrotron sources of X-ray and ultraviolet light in recent years has opened new possibilities for research of matter at the atomic or molecular level, indispensable in the development of new functional nanostructured materials with desired properties. The talk will present the possibilities offered by X-ray absorption spectroscopy with synchrotron light for ex-situ or operando characterization of various functional porous and other nanomaterials, before, after and during their operation [1,2,3,4]. New generation of synchrotron light sources also opened the possibility of combining X-ray absorption with high-resolution emission [5] and inelastic scattering spectroscopy [6], and microscopy with sub-micron resolution [7]. Examples of operando XANES and EXAFS analysis to track changes in the valence states and local structures of selected elements in different energy storage materials and in various (photo)catalysts, during chemical reactions under controlled reaction conditions, will be presented, which provided insight into the dynamic functional properties and reaction mechanisms of these materials. Access to SR facilities of Petra III (beamlines P65, P64 and P01), ESRF (beamlines BM23, ID21, ID26) and Elettra (beamlines XAFS, XRF), for the presented research is kindly acknowledged. Ključne besede: X-ray absorption spectroscopy, operando XANES, EXAFS, catalysts, batteries Objavljeno v RUNG: 07.10.2022; Ogledov: 1832; Prenosov: 0 Gradivo ima več datotek! Več... |
3. Structure and population of complex ionic species in FeCl[sub]2 aqueous solution by X-ray absorption spectroscopyUroš Luin, Iztok Arčon, Matjaž Valant, 2022, izvirni znanstveni članek Opis: Technologies for mass production require cheap and abundant materials such as ferrous chloride (FeCl2). The literature survey shows the lack of experimental studies to validate theoretical conclusions related to the population of ionic Fe-species in the aqueous FeCl2 solution. Here, we present an in situ X-ray absorption study of the structure of the ionic species in the FeCl2 aqueous solution at different concentrations (1–4 molL−1) and temperatures (25–80 ◦C). We found that at low temperature and low FeCl2 concentration, the octahedral first coordination sphere around Fe is occupied by one Cl ion at a distance of 2.33 (±0.02) Å and five water molecules at a distance of 2.095 (±0.005) Å. The structure of the ionic complex gradually changes with an increase in temperature and/or concentration. The apical water molecule is substituted by a chlorine ion to yield a neutral Fe[Cl2(H2O)4]0. The observed substitutional mechanism is facilitated by the presence of the intramolecular hydrogen bonds as well as entropic reasons. The transition from the single charged Fe[Cl(H2O)5]+ to the neutral Fe[Cl2(H2O)4]0 causes a significant drop in the solution conductivity, which well correlates with the existing conductivity models. Ključne besede: structure, population, ionic species, aqueous ferrous chloride, in situ X-ray absorption spectroscopy Objavljeno v RUNG: 24.01.2022; Ogledov: 2681; Prenosov: 43 (1 glas) Povezava na celotno besedilo Gradivo ima več datotek! Več... |
4. Monitoring of chemical processes at the atomic level by X-ray absorption spectrometry using extremely bright synchrotron radiation sourcesIztok Arčon, vabljeno predavanje na konferenci brez natisa Opis: X-ray absorption spectroscopy (XAS) is a powerful tool for characterisation of local structure and chemical state of selected elements in different new functional materials and biological or environmental samples. The XAS spectroscopy is based on extremely bright synchrotron radiation X-rays sources, which allow precise characterisation of bulk, nanostructured or highly diluted samples. The rapid development of extremely bright synchrotron sources of X-ray and ultraviolet light in recent years has opened new possibilities for research of matter at the atomic or molecular level, indispensable in the development of new functional nanostructured materials with desired properties. The lecture will present the possibilities offered by X-ray absorption spectroscopy with synchrotron light for ex-situ and in-situ or operando characterization of various functional porous and other nanomaterials before, after and during their operation. With the operando micro-XANES and EXAFS methods it is possible to track changes in the valence states and local structures of selected elements in different energy storage materials or in various (photo)catalysts, during chemical reactions under controlled reaction conditions, thus gaining insight into the dynamic functional properties and reaction mechanisms of these materials. New synchrotron light sources also opened the possibility of combining X-ray absorption or emission spectroscopy and microscopy with a resolution of up to a few tens of nanometres, crucial for analysis of environmental and biological samples on sub-cellular level, to understand the mechanisms of uptake, transport, accumulation, and complexation of metal cations on subcellular level in various plant tissues or accumulation in environment, to develop effective remediation approaches. Ključne besede: X-ray absorption spectroscopy, EXAFS, XANES, synchrotron radiation sources, operando Objavljeno v RUNG: 15.12.2021; Ogledov: 2631; Prenosov: 0 Gradivo ima več datotek! Več... |
5. Removal of copper from aqueous solutions with zeolites and possible treatment of exhaust materialsNataša Zabukovec Logar, Iztok Arčon, Janez Kovač, Margarita Popova, 2021, izvirni znanstveni članek Opis: The mechanism of Cu2+ loading into commercially available natural HEU-type and synthetic LTA-type zeolites for their
possible use in environmental processes, such as water and air treatment applications, was studied. Elemental analysis,
SEM/EDXS, XRD, XAS and XPS analyses revealed 4-fold coordination of Cu2+ cations with oxygen atoms in the pores, a
predominant location of copper atoms on the surface of crystallites and retained crystallinity of zeolites throughout the
processes. The post-treatment of Cu2+-loaded samples with HCl and/or NaCl solutions confirmed the predominantly
reversible sorption of copper on zeolites from aqueous solutions by ion-exchange mechanism and, therefore, excellent
regeneration possibilities for both types of zeolites. Furthermore, with the calcination of exhaust metal-loaded zeolites,
catalysts for total toluene oxidation reaction, as a model VOC pollutant, were obtained. Ključne besede: Cu2+ ion exchange, Total toluene oxidation, X-ray absorption spectroscopy, X-ray photoelectron spectroscopy, Zeolite Objavljeno v RUNG: 03.06.2021; Ogledov: 2710; Prenosov: 154 Povezava na celotno besedilo Gradivo ima več datotek! Več... |
6. X-ray absorption spectroscopy analysis: in situ, operando, in vivoIztok Arčon, 2020, objavljeni povzetek znanstvenega prispevka na konferenci (vabljeno predavanje) Opis: X-ray absorption spectroscopy (XAS) is a powerful tool for characterisation of local structure and chemical state of selected elements in different new functional materials and biological or environmental samples. The XAS spectroscopy is based on extremely bright synchrotron radiation X-rays sources, which allow precise characterisation of bulk, nanostructured or highly diluted samples. With its two methods (XANES and EXAFS) it enables monitoring changes in valence states and local structures of constituent elements during chemical reactions under controlled reaction conditions, and it offers a possibility of a combination of X-ray spectroscopy and microscopy with sub-micron lateral resolution, crucial for analysis of biological samples on sub-cellular level. In this talk some typical examples of advanced XAS analysis will be presented. Ključne besede: X-ray absorption spectroscopy, EXAFS, XANES, in-situ, operando Objavljeno v RUNG: 17.10.2020; Ogledov: 5494; Prenosov: 0 Gradivo ima več datotek! Več... |
7. X-ray absorption spectroscopy set-up for unstable gases: A study of 5p HydridesRobert Hauko, Jana Padežnik Gomilšek, Alojz Kodre, Iztok Arčon, 2020, izvirni znanstveni članek Opis: An absorption cell is constructed for x-ray absorption spectroscopy of reactive, unstable or hazardous gases at
room temperature. In conjunction with in-situ micro-synthesis technique relying on handling the gas in syringes
it enabled a first measurement of x-ray absorption spectra in the region of K and L edges for the series of hydrides
of 5p elements (SnH4, SbH3, TeH2, HI). The signal-to-noise ratio above 103 was achieved, whereby fine detail is
discerned in the spectra, in particular the small sharp features above each absorption edge, testifying of coexcitations
of outer electrons in the core photoeffect. Ključne besede: X-ray absorption spectroscopy
Micro-synthesis absorption cell
Gaseous hydrides
Multielectron photoexcitations Objavljeno v RUNG: 10.02.2020; Ogledov: 4474; Prenosov: 0 Gradivo ima več datotek! Več... |
8. Trace detection of C2H2 in ambient air using continuous wave cavity ring-down spectroscopy combined with sample pre-concentrationManik Pradhan, Ruth Lindley, Roberto Grilli, Iain R. White, Damien Martin, Orr-Ewing Andrew, 2008, izvirni znanstveni članek Opis: Continuous wave cavity ring-down spectroscopy (cw-CRDS) coupled with sample pre-concentration has been used to measure acetylene (C2H2) mixing ratios in ambient air. Measurements were made in the near-infrared region (λ∼1535.393 nm), using the P(17) rotational line of the (ν1+ν3) vibrational combination band, a region free from interference by overlapping spectral absorption features of other air constituents. The spectrometer is shown to be capable of fast, quantitative and precise C2H2 mixing ratio determinations without the need for gas chromatographic (GC) separation. The current detection limit of the spectrometer following sample pre-concentration is estimated to be 35 parts per trillion by volume (pptv), which is sufficient for direct atmospheric detection of C2H2 at concentrations typical of both urban and rural environments. The CRDS apparatus performance was compared with an instrument using GC separation and flame ionization detection (GC-FID); both techniques were used to analyze air samples collected within and outside the laboratory. These measurements were shown to be in quantitative agreement. The indoor air sample was found to contain C2H2 at a mixing ratio of 3.87±0.22 ppbv (3.90±0.23 ppbv by GC-FID), and the C2H2 fractions in the outside air samples collected on two separate days from urban locations were 1.83±0.20 and 0.69±0.14 ppbv (1.18±0.09 and 0.60±0.04 ppbv by GC-FID). The discrepancy in the first outdoor air sample is attributed to degradation over a 2-month interval between the cw-CRDS and GC-FID analyses. Ključne besede: Rotational Line, Cavity Enhance Absorption Spectroscopy, Adsorbent Trap, Trace Atmospheric Constituent, CRDS Instrument Objavljeno v RUNG: 15.07.2019; Ogledov: 4073; Prenosov: 0 Gradivo ima več datotek! Več... |
9. PHOTO-EXCITATION ENERGY INFLUENCE ON THE PHOTOCONDUCTIVITY OF ORGANIC SEMICONDUCTORSNadiia Pastukhova, 2018, doktorska disertacija Opis: In this work, we experimentally studied the influence of photoexcitation energy
influence on the charge transport in organic semiconductors. Organic semiconductors
were small molecules like corannulene, perylene and pentacene derivatives, polymers
such as polythiophene and benzothiophene derivatives, and graphene, along with
combinations of these materials in heterojunctions or composites.
The first part of this study is focused on the photoexcitation energy influence on
the transient photoconductivity of non-crystalline curved π-conjugated corannulene
layers. The enhanced photoconductivity, in the energy range where optical absorption
is absent, is deduced from theoretical predictions of corannulene gas-phase excited
state spectra. Theoretical analysis reveals a consistent contribution involving
transitions to Super Atomic Molecular Orbitals (SAMOs), a unique set of diffuse
orbitals typical of curved π-conjugated molecules. More, the photoconductivity of the
curved corannulene was compared to the π-conjugated planar N,N′-1H,1H-
perfluorobutyldicyanoperylene-carboxydi-imide
(PDIF-CN2),
where
the
photoexcitation energy dependence of photocurrent closely follows the optical
absorption spectrum.
We next characterized charge transport in poly(3-hexylthiophene) (P3HT) layers
deposited from solution. Our results indicate that time-of-flight (TOF) mobility
depends on the photoexcitation energy. It is 0.4× 10 −3 cm 2 /Vs at 2.3 eV (530 nm) and
doubles at 4.8 eV (260 nm). TOF mobility was compared to field-effect (FET) mobility
of P3HT field-effect transistors (OFETs). The FET mobility was similar to the 2.3 eV
excitation TOF mobility. In order to improve charge mobility, graphene nanoparticles
were blended within a P3HT solution before the deposition. We found that the mobility
significantly improves upon the addition of graphene nanoparticles of a weight ratio
as low as 0.2 %. FET mobility increases with graphene concentration up to a value of
2.3× 10 −2 cm 2 /Vs at 3.2 %. The results demonstrate that phase segregation starts to
influence charge transport at graphene concentration of 0.8 % and above. Hence, the
graphene cannot form a bridged conduction channel between electrodes, which would
cancel the semiconducting effect of the polymer composite.
An alternative approach to enhance mobility is to optimize the molecular ordering
of organic semiconductors. For that purpose, we studied an innovative nanomesh
device. Free-standing nanomesh devices were used to form nanojunctions of N,N′-
iiDioctyl-3,4,9,10-perylenedicarboximide (PTCDI-C8) nanowires and crystalline
bis(triisopropylsilylethinyl)pentacene (TIPS-PEN). We characterized the photocurrent
response time of this novel nanomesh scaffold device. The photoresponse time
depends on the photon energy. It is between 4.5 − 5.6 ns at 500 nm excitation
wavelength and between 6.7 − 7.7 ns at 700 nm excitation wavelength. In addition, we
found that thermal annealing reduces charge carrier trapping in crystalline nanowires.
This confirms that the structural defects are crucial to obtaining high photon-to-charge
conversion efficiency and subsequent transport from pn junction in heterostructured
materials.
Structural defects also influence the power conversion efficiency of organic
heterostructured photovoltaics (OPVs). Anticipating that polymers with different
backbone lengths produce different level of structural defects, we examined charge
transport
dependence
on
the
molecular
weight
of
poly[4,8-bis(5-(2-
ethylhexyl)thiophen-2-yl)benzo[1,2-b;4,5-b']dithiophene-2,6-diyl-alt-(4-(2-
ethylhexyl)-3-fluorothieno[3,4-b]thiophene-)-2-carboxylate-2-6-diyl]
(PTB7-Th)
from 50 kDa to 300 kDa. We found p-type hopping transport in PTB7-Th,
characterized by 0.1 – 3× 10 −2 cm 2 /Vs mobility, which increases with temperature and
electric field. The polymer molecular weight exhibits a non-trivial influence on charge
transport. FET mobility in the saturation regime increases with molecular weight. A
similar trend is observed in TOF mobility and FET mobility in the linear regime,
except for the 100kDa polymer, which manifests in the highest mobility due to reduced
charge trapping. The lowest trapping at the dielectric interface of OFET is observed at
200 kDa. In addition, the 200 kDa polymer exhibits the lowest activation energy of the
charge transport. Although the 100 kDa polymer indicates the highest mobility, OPVs
using the 200 kDa polymer exhibit the best performance in terms of power conversion
efficiency. Ključne besede: organic
semiconductors, optical
absorption
spectroscopy, time-of-flight
photoconductivity, transient photocurrent spectroscopy, organic thin film transistors, atomic force microscopy, superatomic molecular orbitals, pn heterojunction, organic
nanowires, graphene, composites, charge mobility, charge trapping, temperature
dependence, photodetector, photovoltaic, solar cell, organic electronics Objavljeno v RUNG: 08.10.2018; Ogledov: 6751; Prenosov: 170 Celotno besedilo (4,56 MB) |
10. Giant magneto–electric coupling in 100 nm thick Co capped by ZnO nanorodsGiovanni Vinai, Barbara Ressel, Piero Torelli, Federico Loi, Benoit Gobaut, Regina Ciancio, Barbara Casarin, Antonio Caretta, Luca Capasso, Fulvio Parmigiani, Francesco Cugini, Massimo Solzi, Marco Malvestuto, Roberta Ciprian, 2018, izvirni znanstveni članek Ključne besede: ZnO nanorods, Cobalt, X-rays absorption near edge spectroscopy Objavljeno v RUNG: 07.02.2018; Ogledov: 4773; Prenosov: 0 Gradivo ima več datotek! Več... |