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Download source code for Hartree-Fock Program hf.f Select a topic of Hartree-Fock Calculations
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| The Hartree-Fock approximation |
| The Hartree-Fock equation for 1s2p 3 P/. |
| The self-consistent field procedure |
| Hartree-Fock solutions of the ground state of lithium |
| The Hartree-Fock solutions for 1s2s3S and 1S in He |
| The general Hartree-Fock equations |
| - Diagonal energy parameters and Koopmans' Theorem |
| - The fixed-core Hartree-Fock approximation |
| Brillouin's Theorem |
| - General theory |
| - The importance of Brillouin's Theorem |
| Term dependence |
| Iso-electronic sequences and orbital collapse |
| Quantum defects and Rydberg series |
| Computational aspects |
| - The logarithmic grid |
| - Formulas for integration and differentiation |
| - The functions Yk(ab;r) |
| - Solution of the radial equation |