Abstract
For the first time a spin-polarized extended Hartree-Fock calculation on a three-electron system, Li, is reported. The calculations are discussed with primary emphasis on the hyperfine splitting spectrum which is determined by the spin density at the nucleus, Q(0)=|isz(i)(ri)|S. We calculate Q(0) for the ground state to be 0.2403, as compared with the experimental value of 0.2313.
| Original language | English |
|---|---|
| Pages (from-to) | 93-96 |
| Number of pages | 4 |
| Journal | Physical Review |
| Volume | 157 |
| Issue number | 1 |
| DOIs | |
| Publication status | Published - 1 Dec 1967 |
| Externally published | Yes |
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