Ab-initio Green's Functions Calculations of Atoms

C. Barbieri, D. Van Neck
AIP Conference Proceedings
1120, 104-108
2009
A1

Abstract 

The Faddeev random phase approximation (FRPA) method is applied to calculate the ground state and ionization energies of simple atoms. First ionization energies agree with the experiment at the level of ~10 mH or less. Calculations with similar accuracy are expected to provide information required for developing the proposed quasiparticle-DFT method. ©2009 American Institute of Physics