Analytic Wave Functions. II. Atoms with , , , , and Electrons
- 1 February 1959
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 113 (3) , 809-813
- https://doi.org/10.1103/physrev.113.809
Abstract
The variation program for the computation of atomic wave functions which has been developed and programed for IBM-704 electronic data processing machine is detailed. This calculation has been set up so as to be able to handle atoms having any combination of , , , , and electrons. One example of the program is provided by a calculation of the wave functions for aluminum for all degrees of ionization. Another example is provided by a calculation of the fourteen configurations for oxygen having the electron distribution . Finally, the three wave functions thus obtained are combined by means of the configuration interaction.
Keywords
This publication has 2 references indexed in Scilit:
- Analytic Wave Functions. I. Atoms with1s,2s, and2pElectronsPhysical Review B, 1958
- The Theory of Complex SpectraPhysical Review B, 1929