Density-functional calculations for excited-state energies
- 1 June 1988
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review A
- Vol. 37 (12) , 4570-4576
- https://doi.org/10.1103/physreva.37.4570
Abstract
A mathematically rigorous approach for the calculation of excited-state energies within the one-particle density-functional formalism is presented. Since the occurring exchange-correlation functional is not exactly known, approximate schemes are proposed and compared with those by other authors. Our approach gives good figures for the harmonic-oscillator potential and it is explained why the agreement with the exact energies is less for the Coulomb potential.Keywords
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