The nuclear electric quadrupole moment of copper

Abstract

The nuclear electric quadrupole moment (NQM) of the ⁶³Cu nucleus was determined from an indirect approach by combining accurate experimental nuclear quadrupole coupling constants (NQCCs) with relativistic Dirac-Coulomb coupled cluster calculations of the electric field gradient (EFG). The data obtained at the highest level of calculation, DC-CCSD-T, from 14 linear molecules containing the copper atom give rise to an indicated NQM of −198(10) mbarn. Such result slightly deviates from the previously accepted standard value given by the muonic method, −220(15) mbarn, although the error bars are superimposed.