Related papers: Energy level structure and transition data of Er$^…
Large-scale relativistic configuration-interaction calculation of energy levels of core-excited states of lithium-like ions is presented. Quantum electrodynamic, nuclear recoil, and frequency-dependent Breit corrections are included in the…
Density functional calculations are performed for ground [He]2s$^2$ $^1$S$^e$, and three metastable bound excited states, 1s2s2p$^2$ $^5$P$^e$, 1s2p$^3$ $^5$S$^o$, 1s2s2p3p $^5$P$^e$ of Li$^-$ and [He]2s2p$^2$ $^4$P$^e$, [He]2p$^3$…
Structural phase transitions in $f$-electron materials have attracted sustained attention both for practical and basic science reasons, including that they offer an environment to directly investigate relationships between structure and the…
In this work, we report results from our extensive spectroscopic study on AlF and AlCl molecules, keeping in mind potential laboratory as well as astrophysical applications. We carry out detailed electronic structure calculations in both…
Electric dipole ($E1$) response of $^{6}$He is studied with a fully microscopic six-body calculation. The wave functions for the ground and excited states are expressed as a superposition of explicitly correlated Gaussians (CG). Final state…
The energy of the first excited state in the neutron-rich N=28 nucleus 45Cl has been established via in-beam gamma-ray spectroscopy following proton removal. This energy value completes the systematics of the E(1/2^+_1)-E(3/2^+_1) level…
Many-body variational ground-state wave function of two-dimensional electron system (2DES), localized in the main strip (MS)$L_{x}^{\square} \times L_{y}$ of the finite width $L_{x}^{\square}=\sqrt{2 \pi m} \ell_{0}$ (and the periodic…
It has been generally accepted that the threshold structure observed in the oxygen K edge X-ray absorption spectrum in 3d transition metal oxides represents the electronic structure of the 3d transition metal. There is, however, no…
The five J$\Pi$ levels within a $np^2$ or $np^4$ ground state complex provide an excellent testing ground for the comparison of theoretical line ratios with astrophysically observed values, in addition to providing valuable electron…
We use a recently developed version of the configuration method for open shells to study electronic structure of erbium and fermium atoms. We calculate excitation energies of odd states connected to the even ground state by electric dipole…
In a combined experimental and theoretical study we investigate the $7dnl$ and $8pnl$ ($n\ge 11$, $l=9-12$) doubly-excited planetary states of Sr. The experimental spectrum was obtained using a five-photon resonant excitation scheme. The…
Recently a breakthrough has been achieved in laser-spectroscopic studies of short-lived radioactive compounds with the first measurements of the radium monofluoride molecule (RaF) UV/vis spectra. We report results from high accuracy…
The low energy excited $0_{2,3}^+$ states in $^{96}$Sr are amongst the most prominent examples of shape coexistence across the nuclear landscape. In this work, the neutron $[2s_{1/2}]^2$ content of the $0_{1,2,3}^+$ states in $^{96}$Sr was…
The ground state of 2D electrons in high magnetic field is studied by the density matrix renormalization group method. The ground state energy, excitation gap, and pair correlation functions are systematically calculated at various fillings…
Electron impact excitation collision strengths are calculated for all transitions among 113 levels of the 2s$^2$2p$^5$, 2s2p$^6$, 2s$^2$2p$^4$3$\ell$, 2s2p$^5$3$\ell$, and 2p$^6$3$\ell$ configurations of F-like W~LXVI. For this purpose…
A first-principles approach is demonstrated to calculate the relationship between aqueous semiconductor interface structure and energy level alignment. The physical interface structure is sampled using density functional theory based…
For superheavy elements with atomic numbers $120\leq Z \leq 170$, the concept of the ground-state configuration is being reexamined. To this end, relativistic calculations of the electronic structure of the low-lying levels are carried out…
Employing two state-of-the-art methods, second-order many-body perturbation theory and multiconfiguration Dirac-Fock, highly accurate calculations are performed for the lowest 318 fine-structure levels arising from the $2s^{2} 2p^{4}$, $2s…
In this work the excited energy levels, reduced transition probabilities, $B(E2)\uparrow$, intrinsic quadrupole moments and deformation parameters have been calculated for $^{62-68}$Zn isotopes with neutrons (N=32,34,36 and 38 ). Nushellx…
X-ray absorption spectroscopy (XAS) as well as x-ray magnetic circular dichroism (XMCD) and magnetization of hybrid pyrochlore Eu2-xFexTi2O7 were investigated, where the rare earth Eu (4f) was replaced with transition metal Fe (3d) to…