Search results for "Spectroscopy"
showing 10 items of 10293 documents
Modification of LiF structure by irradiation with swift heavy ions under oblique incidence
2013
The structural modifications of LiF irradiated with swift heavy ions under oblique angles have been investigated using AFM, SEM, chemical etching, nanoindentation and optical absorption spectroscopy. LiF crystals were irradiated under incidence angles of 30 and 70 degrees with 2.2 GeV Au (fluence 57?l011 ions-cm2) and 150 MeV Kr ions (fluence 1012?1014 ions?cm?2). Structural study on sample cross-sections shows that two damage regions ? (1) nanostructured zone and (2) dislocation ? rich zone, which are typical for irradiations at normal incidence, appear also in samples irradiated under oblique angles. However in the latter case a more complex structure is formed that leads to stronger ion-…
Vacuum-ultraviolet absorption of hydrogenated and deuterated silanol groups and interstitial water molecules in amorphousSiO2
2005
Vacuum-ultraviolet (VUV) absorption cross sections of hydrogenated and deuterated silanol groups (SiOX, where $\mathrm{X}=\mathrm{H}$ or D) as well as interstitial water molecules $({\mathrm{X}}_{2}\mathrm{O})$ in amorphous $\mathrm{Si}{\mathrm{O}}_{2}$ $(a\text{\ensuremath{-}}\mathrm{Si}{\mathrm{O}}_{2})$ were determined between photon energies of 7 and $8.2\phantom{\rule{0.3em}{0ex}}\mathrm{eV}$. The absorption bands for the deuterated species are blueshifted compared to those for the hydrogenated ones by $\ensuremath{\sim}0.1\phantom{\rule{0.3em}{0ex}}\text{to}\phantom{\rule{0.3em}{0ex}}0.2\phantom{\rule{0.3em}{0ex}}\mathrm{eV}$ as a result of a decrease in the zero-point energy associat…
Photoconversion and dynamic hole recycling process in anion vacancies in neutron-irradiated MgO crystals
1999
Optical spectroscopy and theory demonstrate that photon excitation of the positively charged anion vacancies (F{sup +} centers) at 5.0 eV in neutron-irradiated MgO crystals releases holes that are subsequently trapped at {ital V}-type centers, which are cation vacancies charge compensated by impurities, such as Al{sup 3+}, F{sup {minus}}, and OH{sup {minus}} ions. The concentration of trapped-hole centers was found to exceed that of available anion vacancies. The disproportionately large amount of holes produced is attributed to a dynamic recycling process, by which the F{sup +} center serves to release a hole to the {ital V}-type centers and subsequently trap a hole from an Fe{sup 3+} ion.…
Magnetic Transitions in the Double Perovskite Sr2FeRe1-xFexO6(0≤X≤0.5)
2008
AbstractThe synthesis, structure, and magnetic and transport properties of solid solutions Sr2FeRe1-xFexO6 (0≤x≤0.5) are reported. A structural evolution in the solid solutions from a double perovskite to perovskite is observed with increasing Fe/Re disorder. Except for the metallic parent compound all members of the series are semiconducting. For the Fe-doped samples a change from ferrimagnetic interactions in the parent compound to a complex superposition of ferrimagnetic and antiferromagnetic interactions was observed. The magnetic moment decreases with x, whereas the Curie temperature TC remains unaffected. The magnetic and Mössbauer data suggest Fe to act as a redox-buffer.
Dynamic segregation during ferrite oxidation revealed by XPS
2002
Dynamic segregation phenomena were revealed by XPS during the oxidation of some ferrites (Fe 2.5 Ti 0.5 O 4 , Fe 2.5 Ni 0.5 O 4 , Fe 2 CrO 4 and FeCr 2 O 4 ). This kind of phenomenon induces, at a low temperature (below room temperature), drastic changes in the cationic composition of the most external layers. Dynamic segregation is a function of the cationic composition, the oxidation capability and the morphology of these ferrites. Although dynamic segregation seems to be a quite frequent phenomenon that often can be observed during ferrite oxidation, there are materials in existence where it does not appear, such as molybdenum ferrite.
An Open-Shell Coronoid with Hybrid Chichibabin-Schlenk Conjugation.
2021
A hexaradicaloid molecule with alternating Kekule and non-Kekule connectivities between adjacent spin centers was obtained by fusing two conjugation motifs in Chichibabin and Schlenk hydrocarbons into a coronoid structure. 1 H NMR, ESR, and SQUID experiments and computational analyses show that the system has a singlet ground state with a significant hexaradicaloid character (γ0 =0.826, γ1 =γ2 =0.773). It has multiple thermally accessible high-spin states (up to the septet), with uniform energy gaps of ca 1.0 kcal mol-1 between consecutive multiplicities. In line with its open-shell character, the coronoid has a small electronic band gap (ca. 0.8 eV) and undergoes two consecutive one-electr…
Spin Crossover in Fe(II) Molecular Compounds — Mössbauer and µSR Investigations
2002
The compound [Fe(ptz)6](C104)2 (ptz = 1-propyl-tetrazole) displays a complete and gradual spin crossover centred around 125 K as evidenced by magnetic and muon measurements over the temperature range ∼ 4.2–300 K. Although the crystal structure reveals only one crystallographic site, line broadening is observed in the Mossbauer spectra in the vicinity of the spin transition. The muon spin relaxation behaviour of this compound indicates that a structural transformation rather than dynamic processes may account for the observed spectral features. Both the Mossbauer and muon measurements are consistent with a mixture of high and low spin Fe ions in the transition region.
Coexistence of spin-crossover and antiferromagnetic coupling phenomena in the novel dinuclear Fe(II) complex [Fe(dpa)(NCS)2]2bpym
2003
Abstract The iron(II) spin crossover dinuclear compound [Fe(dpa)(NCS) 2 ] 2 bpym where dpa = 2,2 ′ -dipyridylamine and bpym = 2,2 ′ -bipyrimidine has been synthesized and characterized. Variable-temperature magnetic susceptibility and 57 Fe Mossbauer spectroscopy data provide evidence for a rather complete and continuous S=2 ( HS )↔S=0 (LS) spin-crossover behavior taking place in the temperature range 400–50 K (T 1/2 =245 K ) without the presence of a plateau at 50% of conversion. The absence of such plateau, which is characteristic of all dinuclear compounds so far studied, is interpreted in terms of synergetic effect between intramolecular and intermolecular interactions.
Optical absorption of magnesia-supported gold clusters and nanoscale catalysts: Effects due to the support, clusters, and adsorbants
2005
Polarization-resolved optical spectra of magnesia-supported gold clusters ${\mathrm{Au}}_{N}∕\mathrm{Mg}\mathrm{O}$ $(N=1,2,4,8)$, bound at a surface color center ${F}_{s}$ of the MgO(100) face, are calculated from the time-dependent density functional theory. The optical lines for $N=1,2$ are dominated by transitions that involve strong hybridization between gold and ${F}_{s}$ states whereas for $N=4,8$ intracluster transitions dominate. The theoretical optical spectra are sensitive to cluster structure and adsorbants (here CO and ${\mathrm{O}}_{2}$ molecules on ${\mathrm{Au}}_{8}∕{F}_{s}@\mathrm{Mg}\mathrm{O}$) which suggests polarization-resolved optical spectroscopy as a powerful tool t…