QED corrections in heavy atoms

PJ Mohr, G Plunien, G Soff - Physics Reports, 1998 - Elsevier
The comparison of theory and experiment for energy levels of strongly bound electrons
provides a critical test of quantum electrodynamics in strong fields. A theoretical evaluation …

Quantum chemical calculations and experimental investigations of molecular actinide oxides

A Kovacs, RJM Konings, JK Gibson, I Infante… - Chemical …, 2015 - ACS Publications
Actinides are the heaviest chemical elements with practical relevance. Among them, only
thorium and uranium can be found in nature in substantial quantities, while natural …

Relativistic many-body calculations of energy levels, hyperfine constants, electric-dipole matrix elements, and static polarizabilities for alkali-metal atoms

MS Safronova, WR Johnson, A Derevianko - Physical Review A, 1999 - APS
Removal energies and hyperfine constants of the lowest four ns, np 1/2, and np 3/2 states in
Na, K, Rb, and Cs are calculated; removal energies of the n= 7–10 states and hyperfine …

Combination of the many-body perturbation theory with the configuration-interaction method

VA Dzuba, VV Flambaum, MG Kozlov - Physical Review A, 1996 - APS
An ab initio method for high accuracy calculations for atoms with more than one valence
electron is described. The effective Hamiltonian for the valence electrons is formed using …

Density-functional theory beyond the Hohenberg-Kohn theorem

A Görling - Physical Review A, 1999 - APS
A density-functional theory that treats all states of an electronic system on the same footing is
introduced. The corresponding Kohn-Sham formalism can be applied to ground and excited …

All-electron and relativistic pseudopotential studies for the group 1 element polarizabilities from K to element 119

IS Lim, P Schwerdtfeger, B Metz, H Stoll - The Journal of chemical …, 2005 - pubs.aip.org
Two-component and scalar relativistic energy-consistent pseudopotentials for the group 1
elements from K to element 119 are presented using nine electrons for the valence space …

Critically evaluated theoretical energies, lifetimes, hyperfine constants, and multipole polarizabilities in

MS Safronova, UI Safronova - Physical Review A—Atomic, Molecular, and …, 2011 - APS
Systematic study of Rb atomic properties is carried out using a high-precision relativistic all-
order method. Excitation energies of the ns, np, nd, and nf (n⩽ 10) states in neutral rubidium …

Assessing excited state methods by adiabatic excitation energies

R Send, M Kühn, F Furche - Journal of Chemical Theory and …, 2011 - ACS Publications
We compile a 109-membered benchmark set of adiabatic excitation energies (AEEs) from
high-resolution gas-phase experiments. Our data set includes a variety of organic …

Precision determination of weak charge of from atomic parity violation

SG Porsev, K Beloy, A Derevianko - Physical Review D—Particles, Fields …, 2010 - APS
We discuss results of the most accurate to-date test of the low-energy electroweak sector of
the standard model of elementary particles. Combining previous measurements with our …

[HTML][HTML] Electronic structure theory of the superheavy elements

E Eliav, S Fritzsche, U Kaldor - Nuclear Physics A, 2015 - Elsevier
High-accuracy calculations of atomic properties of the superheavy elements (SHE) up to
element 122 are reviewed. The properties discussed include ionization potentials, electron …