Search results for " Paramagnetic resonance"

showing 10 items of 567 documents

High-precision measurement of the electron spin g factor of trapped atomic nitrogen in the endohedral fullerene N@C60

2018

Abstract The electronic g factor carries highly useful information about the electronic structure of a paramagnetic species, such as spin-orbit coupling and dia- or paramagnetic (de-)shielding due to local fields of surrounding electron pairs. However, in many cases, a near “spin-only” case is observed, in particular for light elements, necessitating accurate and precise measurement of the g factors. Such measurement is typically impeded by a “chicken and egg situation”: internal or external reference standards are used for relative comparison of electron paramagnetic resonance (EPR) Larmor frequencies. However, the g factor of the standard itself usually is subject to a significant uncerta…

Nuclear and High Energy PhysicsElectron pairMaterials scienceFullereneLiquid heliumBiophysics02 engineering and technologyElectronic structure010402 general chemistry021001 nanoscience & nanotechnologyCondensed Matter Physics01 natural sciencesBiochemistryArticle0104 chemical scienceslaw.inventionParamagnetismlawPhysics::Atomic and Molecular ClustersEndohedral fullereneMolecular orbitalAtomic physics0210 nano-technologyElectron paramagnetic resonanceJournal of Magnetic Resonance
researchProduct

Radiation-induced effects in neutron- and electron-irradiated lithium silicate ceramic breeder pebbles

2020

Abstract Ceramic breeder (CB) pebbles consisting of lithium orthosilicate (Li4SiO4) as the main phase and lithium metasilicate (Li2SiO3) as a secondary phase were analysed with respect to radiation-induced defects and radiolysis products. Therefore, pebbles that were irradiated with neutrons in the so-called HICU experiment ( H igh neutron fluence i rradiation of pebble sta c ks for f u sion) were compared to pebbles irradiated with accelerated electrons and to an unirradiated sample. Fourier transformation infrared spectroscopy was used to investigate changes in the phase composition. Beside an expected increase in the second phase in the neutron-irradiated samples, no further significant …

Nuclear and High Energy PhysicsLithium metasilicateMaterials scienceRadiochemistrychemistry.chemical_element02 engineering and technology021001 nanoscience & nanotechnology01 natural sciences010305 fluids & plasmaslaw.inventionchemistry.chemical_compoundNuclear Energy and Engineeringchemistrylaw0103 physical sciencesRadiolysisElectron beam processingGeneral Materials ScienceNeutronLithiumIrradiationOrthosilicate0210 nano-technologyElectron paramagnetic resonanceJournal of Nuclear Materials
researchProduct

Oxygen-excess-related point defects in glassy/amorphous SiO2 and related materials

2012

Abstract An insight is given into recent experimental advances in the spectroscopic studies of oxygen-excess intrinsic defects, in glassy SiO 2 and α-quartz. By controlling excess oxygen in a-SiO 2 , and the conditions of F 2 -laser irradiation, SiO 2 glass samples can be obtained with optical absorption almost exclusively dominated by single defect, oxygen dangling bonds (“non-bridging oxygen hole centers” or NBOHCs), without the presence of complementary Si dangling bonds (generic “E′-centers”). This allows for a more accurate determination of the spectral shape of NBOHC optical absorption in UV and vacuum UV spectral regions. The temperature dependence of NBOHC electron paramagnetic reso…

Nuclear and High Energy PhysicsMaterials scienceDangling bondCrystal structureMolecular physicsCrystallographic defectlaw.inventionAmorphous solidCrystallographylawPhase (matter)Electron paramagnetic resonanceAbsorption (electromagnetic radiation)LuminescenceInstrumentationNuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms
researchProduct

Hybrid density functional calculations of hyperfine coupling tensor for hole-type defects in MgAl2O4

2020

This work has been performed within the framework of the EUROfusion Enabling Research project: ENR-MFE19.ISSP-UL-02 “Advanced experimental and theoretical analysis of defect evolution and structural disordering in optical and dielectric materials for fusion application”. The views and opinions expressed herein do not necessarily reflect those of the European Commission.

Nuclear and High Energy PhysicsMaterials scienceMgAl2O4 (spinel)02 engineering and technologyType (model theory)engineering.material010402 general chemistry01 natural sciencesMolecular physicsResonance (particle physics)Spectral linelaw.inventionParamagnetismlaw:NATURAL SCIENCES:Physics [Research Subject Categories]TensorElectron paramagnetic resonanceInstrumentationHole-type defects (V-centres)Relaxation (NMR)Spinel021001 nanoscience & nanotechnology3. Good health0104 chemical sciencesHybrid DFT calculations (B3LYP)engineering0210 nano-technologyNuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms
researchProduct

ESR response of watch glasses to neutron irradiation

2012

Abstract In this paper we report the results of the electron spin resonance (ESR) study of the radiation-induced signal of watch glasses exposed to neutrons. This work extends the series of analyses of the response of watch glasses to various radiation beams which our research group is carrying out for possible applications in retrospective dosimetry. We have considered fluences up to about 3 × 1011 cm−2. We evaluated the signal fading and we found that in the first hours after exposure the signal rapidly decreases. After about 1000 h, it decreases much more slowly. The signal was reduced by about 25% in about 5 months. The radiation induced signal is found to be linearly dependent on neutr…

Nuclear and High Energy PhysicsMaterials scienceSettore ING-IND/20 - Misure E Strumentazione NucleariEPR Accidental dosimetry Watch glasses NeutronsRadiationSignalFluencehumanitiesSettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)law.inventionNuclear magnetic resonancelawNeutron fluxDosimetryNeutronAtomic physicsNeutron irradiationElectron paramagnetic resonanceInstrumentation
researchProduct

Radiation effects on silica-based preforms and optical fibers-II: Coupling ab initio simulations and experiments

2008

International audience; Abstract—Experimental characterization through electron paramagnetic resonance (EPR) and confocal luminescence microscopy (CML) of a Ge-doped glass (preform and fiber) reveals the generation of several point defects by 10 keV X-ray radiation-induced attenuation: GeE', Ge(1), Ge(2), and Ge-ODC. The generation mechanisms of Ge-ODC and charged defects like GeE' centers are studied through ab initio simulation. Our calculations used a 108 atom supercell with a glass composition comparable to the Ge-doped core or to the pure-silica cladding of the canonical sample. The large size of our cell allows us to study the influence of the local environment surrounding the X-ODC d…

Nuclear and High Energy PhysicsMaterials scienceoptical fibersAb initio02 engineering and technology01 natural sciencesMolecular physicslaw.inventionlawAb initio quantum chemistry methods0103 physical sciencesAtomElectrical and Electronic Engineeringdensity functionalElectron paramagnetic resonancetheorydefects010302 applied physics[PHYS.PHYS.PHYS-OPTICS]Physics [physics]/Physics [physics]/Optics [physics.optics]021001 nanoscience & nanotechnologyCrystallographic defectOptical fiber photosensitivity absorption luminescenceAmorphous solidBond lengthNuclear Energy and Engineeringsilicaradiation effectsAb initio calculationssilica.0210 nano-technologyLuminescence
researchProduct

ENDOR Spectroscopic and Molecular Orbital Study of the Dynamical Properties of the Side Chain in Radical Anions of Ubiquinones Q-1, Q-2, Q-6, and Q-10

2000

Abstract The dynamics of the side chain of the radical anions of ubiquinones Q-1 (2,3-dimethoxy-5-methyl-6-[3-methyl-2-butenyl]-1,4-benzoquinone), Q-2, Q-6, and Q-10 have been investigated using electron nuclear double-resonance (ENDOR) spectroscopy. When radicals are produced in the liquid phase, secondary radicals are also formed. The EPR spectra of these additional radicals overlap with the radical of interest. ENDOR spectroscopy was found to be capable for studying the dynamical properties of such conditions. The temperature dependence of the isotropic hyperfine coupling constants of the β- and γ-protons of the side chain was measured. The activation energy of the rotation and other dyn…

Nuclear and High Energy PhysicsPhase transitionZeeman effectEthanolUbiquinoneChemistryRadicalElectron Spin Resonance SpectroscopyBiophysicsCondensed Matter PhysicsBiochemistryMolecular physicslaw.inventionsymbols.namesakeComputational chemistrylawSolventssymbolsSide chainMolecular orbitalProtonsSpectroscopyElectron paramagnetic resonanceBasis setJournal of Magnetic Resonance
researchProduct

Generation of a 7.4 mT ESR doublet induced by γ rays in amorphous-SiO2

2000

Abstract Paramagnetic defects induced by γ rays, in a dose range from 1 to 1000 Mrad, have been investigated by electron spin resonance (ESR) spectroscopy in various types of natural and synthetic silica, having different OH content. A doublet with a field splitting of 7.4 mT, arising from the hyperfine interaction of an unpaired electron with a H nucleus associated with the H(I) center, was detected in all the investigated samples. This ESR structure exhibits a sublinear growth with the γ dose linearly correlated with the γ-induced photoluminescence band at 4.4 eV. The intensity ratio of these two signals depends on the OH content of the sample. Our results agree with a model in which the …

Nuclear and High Energy PhysicsPhotoluminescenceChemistryAnalytical chemistryHydrogen atomlaw.inventionAmorphous solidParamagnetismUnpaired electronlawAtomic physicsElectron paramagnetic resonanceSpectroscopyInstrumentationHyperfine structureNuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms
researchProduct

Bleaching and thermal recovery of PL emissions in natural silica

2000

Abstract We have investigated the bleaching of two photoluminescence (PL) emissions at 3.1 and 4.2 eV and the related growth of an electron spin resonance (ESR) signal, consisting in a hyperfine doublet split by 11.8 mT, in natural silica γ-irradiated by low doses, up to 1 Mrad. These observations definitely support the existence of a conversion mechanism, from optically active defects to paramagnetic ones. To further investigate this conversion process and the stability of the γ-induced paramagnetic centers, we performed PL and ESR measurements in samples that, after a γ exposure at 1 Mrad dose, were thermally treated at various temperatures ranging from 330 to 430 K. We found that the int…

Nuclear and High Energy PhysicsPhotoluminescenceThermal recoveryChemistryAnnealing (metallurgy)Low doseAnalytical chemistryOptically activelaw.inventionParamagnetismlawElectron paramagnetic resonanceInstrumentationHyperfine structureNuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms
researchProduct

Sensitivity enhancement in pulse EPR distance measurements

2004

Established pulse EPR approaches to the measurement of small dipole-dipole couplings between electron spins rely on constant-time echo experiments to separate relaxational contributions from dipolar time evolution. This requires a compromise between sensitivity and resolution to be made prior to the measurement, so that optimum data are only obtained if the magnitude of the dipole-dipole coupling is known beforehand to a good approximation. Moreover, the whole dipolar evolution function is measured with relatively low sensitivity. These problems are overcome by a variable-time experiment that achieves suppression of the relaxation contribution by reference deconvolution. Theoretical and exp…

Nuclear and High Energy PhysicsProtein ConformationBiophysicsAnalytical chemistryBiochemistrySensitivity and Specificitylaw.inventionlawspin labelingSensitivity (control systems)protein structurepair correlation functionElectron paramagnetic resonanceCouplingSpinsChemistryPulsed EPRRelaxation (NMR)Time evolutionElectron Spin Resonance SpectroscopyPhotosystem II Protein ComplexReproducibility of ResultsSignal Processing Computer-AssistedELDORCondensed Matter PhysicsComputational physicsDeconvolutionEPRAlgorithms
researchProduct