JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS

Hylleraas-Configuration Interaction study of the ground state of the negative Li ion
Sims JS
In a previous work Sims and Hagstrom [J. Chem. Phys. 140, 224312 (2014)] reported Hylleraas-Configuration Interaction (Hy-CI) method variational calculations for the neutral atom and positive ion ground states of the beryllium isoelectronic sequence. The Li ion, nominally the first member of this series, has a decidedly different electronic structure. This paper reports the results of a large, comparable calculation for the Li ground state to explore how well the Hy-CI method can represent the more diffuse L shell of Li which is representative of the Be(2sns) excited states as well. The best non-relativistic energy obtained was -7.500 776 596 hartree, indicating that 10 - 20 nh accuracy is attainable in Hy-CI and that convergence of the double cusp is fast and that this correlation type can be accurately represented within the Hy-CI model.
High-precision measurement of the X-ray Cu K spectrum
Mendenhall MH, Henins A, Hudson LT, Szabo CI, Windover D and Cline JP
The structure of the X-ray emission lines of the Cu K complex has been remeasured on a newly commissioned instrument, in a manner directly traceable to the Système Internationale definition of the meter. In this measurement, the region from 8000 eV to 8100 eV has been covered with a highly precise angular scale, and well-defined system efficiency, providing accurate wavelengths and relative intensities. This measurement updates the standard multi-Lorentzian-fit parameters from Härtwig, Hölzer, , and is in modest disagreement with their results for the wavelength of the K line when compared via quadratic fitting of the peak top; the intensity ratio of K to K agrees within the combined error bounds. However, the position of the fitted top of K is very sensitive to the fit parameters, so it is not believed to be a robust value to quote without further qualification. We also provide accurate intensity and wavelength information for the so-called K "satellite" complex. Supplementary data is provided which gives the entire shape of the spectrum in this region, allowing it to be used directly in cases where simplified, multi-Lorentzian fits to it are not sufficiently accurate.
Moments of dipole oscillator-strength distribution for the helium sequence
Khan F, Khandelwal GS and Wilson JW
The moments S(mu) for -6 < or = mu < or = 2 and L(mu) for mu = 0, 1 and 2 are calculated for the helium sequence for atomic numbers Z up to 30 under a screened hydrogenic model. In this model, one describes the atom by single-particle hydrogenic wavefunctions and treats the initial and the final state as characterised by two different effective charge parameters Zi and Zf, respectively. An asymptotic expansion is made of the differential oscillator strength of the screened hydrogenic model. Assuming the value 287.6 for the coefficient of the term epsilon -7/2 for helium atom as given by Salpeter and Zaidi, the parameter Zf is determined for the helium sequence. This approach has resulted in values which are in reasonable agreement with the various moment values of other authors.
Static multipole polarisabilities and second-order Stark shift in francium
Khan F, Khandelwal GS and Wilson JW
The multipole polarisability of the ground state of francium is calculated by utilising both the variational technique of Davison and the quantum defect theory underlying the Bates-Damgaard method. This approach is also shown to yield reasonable results for other alkali atoms. Second-order Stark shift for the ground state of francium is presented as a function of field strength for possible future experimental comparison.
Asymptotic expansions of the hydrogenic radial dipole integral
Dubey R, Khandelwal GS and Pritchard WM
A method is presented for an asymptotic expansion of the hydrogenic radial dipole integral for discrete-discrete transitions from initial state n'l' to final state nl. The advantage of this simple method is that it allows all the necessary algebraic manipulations to be done by the computer programming package REDUCE-2. Expansion coefficients up to the coefficient of the l/n17 term are obtained for all initial states with n' < or = 10. However, only the coefficients which are not calculated by Klarsfeld are tabulated in this paper.
A few selected contributions to electron and photon collisions with H and
Schneider BI, Collins LA, Bartschat K, Guan X and Hu SX
We discuss a number of aspects regarding the physics of and H. This includes low-energy electron scattering processes and the interaction of both weak (perturbative) and strong (ultrafast/intense) electromagnetic radiation with those systems.
A semiclassical theory of phase-space dynamics of interacting bosons
Mathew R and Tiesinga E
We study the phase-space representation of dynamics of bosons in the semiclassical regime where the occupation number of the modes is large. To this end, we employ the van Vleck-Gutzwiller propagator to obtain an approximation for the Green's function of the Wigner distribution. The semiclassical analysis incorporates interference of classical paths and reduces to the truncated Wigner approximation (TWA) when the interference is ignored. Furthermore, we identify the Ehrenfest time after which the TWA fails. As a case study, we consider a single-mode quantum nonlinear oscillator, which displays collapse and revival of observables. We analytically show that the interference of classical paths leads to revivals, an effect that is not reproduced by the TWA or a perturbative analysis.
Spectroscopic analysis of N-intrashell transitions in Rb-like to Ni-like Yb ions
Dipti , Silwal R, Dreiling JM, Sanders SC, Takacs E and Ralchenko Y
Extreme ultraviolet spectra of highly-charged ytterbium ions produced in an electron beam ion trap at the National Institute of Standards and Technology were observed with a flat-field grazing incidence spectrometer in the wavelength region of about 4 nm-20 nm. The measured spectra were interpreted through detailed analysis by collisional-radiative modeling of the non-Maxwellian EBIT plasma. Seventy-nine new spectral lines due to intrashell (Δ = 0, = 4) electric-dipole, magnetic-dipole, and electric-quadrupole transitions were identified in Rb-like Yb through Ni-like Yb ions. The effects of strong configuration interaction within the = 4 complex on the measured spectra are discussed for a number of ionization stages.
The Molybdenum K-shell X-ray Emission Spectrum
Mendenhall MH, Hudson LT, Szabo CI, Henins A and Cline JP
We present newly measured spectra of the X-ray emission of a molybdenum metal anode subject to electron bombardment, using a very high dispersion silicon double-crystal spectrometer. The measurement includes the dipole-allowed , , and emission lines, based on an energy scale traceable to the Système International (SI) definition of the meter with a systematic uncertainty below Δ = 10. The data are presented as parametrized multi-Lorentzian fits to the results, and as supplementary data with the complete spectrum of each line group, corrected for instrumental effects. The Mo ( ) line energy was in complete statistical agreement with published measurements, and it showed no asymmetry. Other lines showed varying discrepancies with the literature which lie outside the bounds of probable experimental errors.