Relativistic coupled-cluster calculations of ²⁰Ne, ⁴⁰Ar, ⁸⁴Kr and ¹²⁹Xe: correlation energies and dipole polarizabilities
classification
⚛️ physics.atom-ph
keywords
coupled-clusterrelativisticcalculationscorrelationtheorydipoleenergiesatoms
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We have carried out a detailed and systematic study of the correlation energies of inert gas atoms Ne, Ar, Kr and Xe using relativistic many-body perturbation theory and relativistic coupled-cluster theory. In the relativistic coupled-cluster calculations, we implement perturbative triples and include these in the correlation energy calculations. We then calculate the dipole polarizability of the ground states using perturbed coupled-cluster theory.
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