Effect of positive-energy orbitals on the configuration-interaction calculation of theH−atom
- 1 February 1991
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review A
- Vol. 43 (3) , 1218-1222
- https://doi.org/10.1103/physreva.43.1218
Abstract
We present the theoretical energy eigenvalues of the S ground state and the (pp state of calculated in a simple configuration-interaction procedure, using a finite set of -basis functions constructed from one-electron hydrogenic orbitals. The energy corrections, due to the electron-electron interaction between configurations with various combinations of bound (negative-energy) and continuum (positive-energy) orbitals, are examined in detail. In particular, our calculation has shown that the continuum-continuum type of configurations contribute approximately 15% and 13%, respectively, to the electron affinity of the S ground state and the (pp state of . In addition, our calculation has shown that the calculated oscillator strength for the transition from the S ground state of to the lowest P Feshbach resonance below the n=2 threshold is significantly reduced (nearly 30%) by the presence of the continuum-continuum type of configurations in the ground-state wave function.
Keywords
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