6533b852fe1ef96bd12ab7fe

RESEARCH PRODUCT

High-precision ab initio calculations of the spectrum of Lr$^+$

Anastasia BorschevskyEphraim EliavE. V. KahlM. LaatiaouiJulian C. Berengut

subject

PhysicsSPECTROSCOPYSETSAtomic Physics (physics.atom-ph)ENERGIESFOS: Physical scienceschemistry.chemical_elementConfiguration interaction01 natural sciencesSpectral lineLutetiumPhysics - Atomic Physics010305 fluids & plasmasFock spaceATOMSCoupled clusterchemistryAb initio quantum chemistry methodsIonization0103 physical sciencesPROGRAMddc:530Atomic physics010306 general physicsLawrencium

description

The planned measurement of optical resonances in singly-ionised lawrencium (Z = 103) requires accurate theoretical predictions to narrow the search window. We present high-precision, ab initio calculations of the electronic spectra of Lr$^+$ and its lighter homologue lutetium (Z = 71). We have employed the state-of-the-art relativistic Fock space coupled cluster approach and the AMBiT CI+MBPT code to calculate atomic energy levels, g-factors, and transition amplitudes and branching-ratios. Our calculations are in close agreement with experimentally measured energy levels and transition strengths for the homologue Lu$^+$ , and are well-converged for Lr$^+$ , where we expect a similar level of accuracy. These results present the first large-scale, systematic calculations of Lr$^+$ and will serve to guide future experimental studies of this ion.

10.1103/physreva.100.062505