Search results for "Effective nuclear charge"
showing 10 items of 128 documents
Isotope-shift measurements of stable and short-lived lithium isotopes for nuclear-charge-radii determination
2010
Changes in the mean-square nuclear charge radii along the lithium isotopic chain were determined using a combination of precise isotope shift measurements and theoretical atomic structure calculations. Nuclear charge radii of light elements are of high interest due to the appearance of the nuclear halo phenomenon in this region of the nuclear chart. During the past years we have developed a new laser spectroscopic approach to determine the charge radii of lithium isotopes which combines high sensitivity, speed, and accuracy to measure the extremely small field shift of an 8 ms lifetime isotope with production rates on the order of only 10,000 atoms/s. The method was applied to all bound iso…
Evidence of a sudden increase in the nuclear size of proton-rich silver-96
2021
Understanding the evolution of the nuclear charge radius is one of the long-standing challenges for nuclear theory. Recently, density functional theory calculations utilizing Fayans functionals have successfully reproduced the charge radii of a variety of exotic isotopes. However, difficulties in the isotope production have hindered testing these models in the immediate region of the nuclear chart below the heaviest self-conjugate doubly-magic nucleus 100Sn, where the near-equal number of protons (Z) and neutrons (N) lead to enhanced neutron-proton pairing. Here, we present an optical excursion into this region by crossing the N = 50 magic neutron number in the silver isotopic chain with th…
Analytic response relativistic coupled-cluster theory: the first application to indium isotope shifts
2019
With increasing demand for accurate calculation of isotope shifts of atomic systems for fundamental and nuclear structure research, an analytic energy derivative approach is presented in the relativistic coupled-cluster theory framework to determine the atomic field shift and mass shift factors. This approach allows the determination of expectation values of atomic operators, overcoming fundamental problems that are present in existing atomic physics methods, i.e. it satisfies the Hellmann-Feynman theorem, does not involve any non-terminating series, and is free from choice of any perturbative parameter. As a proof of concept, the developed analytic response relativistic coupled-cluster the…
On the electrophoretic mobility of isolated colloidal spheres
2004
We studied the electrophoretic mobility μ of highly charged colloidal spheres in very dilute low salt aqueous suspension. We combined experiments on individual particles and ensemble averaged measurements. In both cases μ was observed to be independent of particle size and surface chemistry. Corresponding effective charges Zμ*, however, scaled with the ratio of particle size to Bjerrum length λB: Zμ* = Aa/λB with a coefficient . Our results are discussed in comparison to other charge determination experiments and charge renormalization theory and with respect to the issue of charge polydispersity.
Atomic and electronic structure of both perfect and nanostructured Ni(111) surfaces: First-principles calculations
2011
article i nfo In this study, we perform first principles simulations on both atomically smooth and nanostructured Ni(111) slabs. The latter contains periodically distributed nickel nanoclusters atop a thin metal film gradually growing from adatoms and serving as a promising catalyst. Applying the generalized gradient approximation within the formalism of the density functional theory we compare the atomic and electronic structures of Ni bulk, as well as both perfect and nanostructured (111) surfaces obtained using two different ab initio approaches: (i) the linear combination of atomic orbitals and (ii) the projector augmented plane waves. The most essential inter-atomic forces between the …
Process-independent strong running coupling
2016
We unify two widely different approaches to understanding the infrared behaviour of quantum chromodynamics (QCD), one essentially phenomenological, based on data, and the other computational, realised via quantum field equations in the continuum theory. Using the latter, we explain and calculate a process-independent running-coupling for QCD, a new type of effective charge that is an analogue of the Gell-Mann--Low effective coupling in quantum electrodynamics. The result is almost identical to the process-dependent effective charge defined via the Bjorken sum rule, which provides one of the most basic constraints on our knowledge of nucleon spin structure. This reveals the Bjorken sum to be…
Consistence of the Mean Field Description of Charged Colloidal Crystal Properties
2006
The Debye-Huckel-Potential in combination with an effective or renormalized charge is a widely and often successfully used concept to describe the interaction in charged colloidal model systems and the resulting suspension properties. In particular the phase behaviour can be described in dependence of the parameters particle number density, salt concentration and effective charge. We performed simultaneous measurements of the phase behaviour, the shear modulus and the low frequency conductivity of deionised aqueous suspensions of highly charged colloidal spheres. From the shear modulus the interaction potential at the nearest neighbour distance in terms of a Debye-Huckel potential can be de…
Ab initio Hartree-Fock calculations of LaMnO3 (110) surfaces
2003
We present the results of ab initio Hartree-Fock calculations of the LaMnO3 (110) surface. Using seven-plane slabs, periodic in 2D and containing three formula units, we compare the properties of a stoichiometric surface with oxygen vacancies, and non-stoichiometric, defect-free surfaces, analyze the dispersion of the effective charges near the surface, and calculate the surface energy before and after relaxation, for both ferromagnetric and antiferromagnetic spin orderings in a slab. q 2003 Elsevier Ltd. All rights reserved.
Investigation of lattice dynamical and dielectric properties of MgO under high pressure by means of mid- and far-infrared spectroscopy.
2013
We investigate the lattice dynamical and dielectric properties of MgO single crystals and powders by measurements in the mid- and far-infrared frequency region under high pressures, ranging up to 21.7 GPa. The shift of the restrahlen region is used to determine the pressure dependence of the transverse and longitudinal optical modes. The analysis of the refractive index in the mid- and far-infrared region allowed us to obtain the pressure behavior of the static and electronic dielectric constants. The transverse effective charge slowly decreases under high pressure, reflecting the stability of MgO. As a consequence, the pressure dependence of the static and electronic dielectric constants i…
Ground state and electronic spectrum of Cu(ii) and Cu(iii) complexes of N,N′-1,2-phenylenebis-2-mercaptoacetamide
2009
The electronic structure and the UV-vis spectrum of reduced and oxidized model systems of the N,N'-1,2-phenylenebis(2-mercapto-2-methylpropionamide) copper complex have been studied using a multiconfigurational quantum chemical method (CASSCF/CASPT2). The bonds between Cu and the two sulfur ligand atoms have a large covalent character in the oxidized Cu(III) form. As a result of the increased covalency, the effective charge on the Cu atom is actually smaller in the oxidized form. The electronic spectrum for both oxidation states of the complex is in agreement with the experiment for excitation energies and intensities showing that the theoretical description of the electronic structure is e…