Search results for "crystal field"
showing 10 items of 20 documents
Measuring the magnetic dipole transition of single nanorods by spectroscopy and Fourier microscopy
2020
International audience; Rare-earth doped nanocrystals possess optical transitions with significant either electric or magnetic dipole characters. They are of considerable interest for understanding and engineering light-matter interactions at the nanoscale with numerous applications in nanophotonics. Here, we study the 5 D 0 → 7 F 1 transition dipole vector in individual NaYF 4 : Eu 3+ nanorod crystals by Fourier and confocal micro-scopies. A single-crystal host matrix leads to narrow emission lines at room temperature that permit separation of the Stark sublevels resulting from the crystal-field splitting. We observe a fully magnetic transition and low variability of the transition dipole …
Electron Spin Resonance study of charge trapping in α-ZnMoO4 single crystal scintillator
2015
The origin and properties of electron and hole traps simultaneously appearing in a-ZnMoO4 scintillator after X-ray irradiation at low temperatures (T < 35 K) were studied by Electron Spin Resonance (ESR). ESR spectrum of the electron type trap shows pronounced superhyperfine structure due to the interaction of electron spin with nuclear magnetic moments of 95,97Mo and 67Zn lattice nuclei. Considering the nearly tetragonal symmetry of the center this allows us to identify the electron trap as an electron self-trapped at the (Mo(1)O4) 2 complex. Nearly 60% reduction of the spin–orbit coupling at the Mo(1) ion is caused by the overlap of the Mo and ligand oxygen orbitals indicating an essentia…
Study of the thermochromic phase transition in CuMo1−xWxO4 solid solutions at the W L3-edge by resonant X-ray emission spectroscopy
2021
Abstract Polycrystalline CuMo 1 − x W x O 4 solid solutions were studied by resonant X-ray emission spectroscopy (RXES) at the W L 3 -edge to follow a variation of the tungsten local atomic and electronic structures across thermochromic phase transition as a function of sample composition and temperature. The experimental results were interpreted using ab initio calculations. The crystal-field splitting parameter Δ for the 5d(W)-states was obtained from the analysis of the RXES plane and was used to evaluate the coordination of tungsten atoms. Temperature-dependent RXES measurements were successfully employed to determine the hysteretic behaviour of the structural phase transition between t…
An interpretation of EPR spectra of azide ligated superoxide dismutase from Propionibacterium shermanii
1995
A self-consistent description of the EPR spectra of the azide ligated SOD is obtained by taking into account the general configuration of the crystal field splitting in the crystal field Hamiltonian. The spread in the rhombicity parameter due to the presence of different conformational substates is introduced.
EPR Studies of Atomic Impurities in Rare Gas Matrices
2003
In this article we give an overview of the matrix isolation technique combined with electron paramagnetic resonance (EPR) detection for embedded atomic impurities in solid rare gases. A special emphasis is put on impurity – matrix coupling effects combining both experimental and theoretical approaches.
Rational design and modelling of f-block molecular nanomagnets
2016
Los imanes monomoleculares o moléculas imán, por sus siglas en inglés SMMs, han suscitado una gran atención en los últimos años debido a sus extraordinarias propiedades físicas. Los cristales de este tipo de moléculas se caracterizan por presentar relajación lenta de la magnetización a baja temperatura, así como curvas de histeresis magnética. Estas moléculas se encuentran entre las entidades con comportamiento magnético más complejas, mostrando fenómenos cuánticos tales como efecto túnel en la magnetización, coherencia cuántica o interferencia cuántica. Por esto, se han postulado como candidatos prometedores para el diseño de bits cuánticos (qubits) de espín en computación cuántica. La pri…
Crystal field splitting of some rare earth intermetallic compounds with Cu3Au structure
1980
Inelastic neutron scattering studies were performed in the paramagnetic phases of several rare earth compounds that crystallize in the cubic Cu3Au structure: ErPb3, ErTl3, ErIn3, HoPb3, HoTl3, HoIn3, PrSn3, PrPb3, PrTl3, PrIn3, CeIn3, La1−c Pr c Tl3, and Pr(In0.5Tl0.5)3. The energies, widths and intensities of the crystal field excitations are determined and discussed in terms of interactions between the rare earth ions. Variations of the crystal field parameters are observed across the series.
Crystal field calculations of energy levels of the Ni2+ ions in MgO
2013
Abstract The electronic energy levels of six-fold coordinated Ni 2+ ion in magnesium oxide MgO were calculated using the exchange charge model of crystal field theory. The calculated energetic positions of the Ni 2+ levels match well the experimental spectrum. Inclusion of the spin-orbit (SO) interaction is compulsory to account for the first excited 3 T 2g state fine structure; however, it does not explain why out of four levels arising from the 3 T 2g state, only two are seen in the experimental spectra. One possible explanation to this fact can be advanced by invoking the Jahn–Teller effect.
Effects of Crystal Field Splitting and Surface Faceting on the Electronic Shell Structure
1992
The shell structure of the valence electrons is clearly observed in all alkali and noble metal clusters containing up to hundreds of atoms[1 – 4]. It is seen in the abundances of the clusters, in the ionization potential and in the polarizability. The shell structure of the valence electrons is closely related to the shell model of nuclei, but is simpler owing to the negligibly small spin-orbit interaction. The ability to produce all sizes of metal clusters has made the metal clusters a test ground for the super-shell structure[5].
Electronic Shell Structure and the Crystal Field Splitting in Simple Metals Clusters
1991
An upper limit for the number of atoms in metal clusters capable of exhibiting electronic shell structure has been estimated by comparing the energy difference between the highest occupied and the lowest unoccupied state with the crystal field splitting. The former is obtained by solving the Schrodinger equation for a spherical potential well with hard walls while the latter is obtained from the band structure of the solid. The results indicate that shell structures may persist in clusters containing as many as a million atoms.