dorsal/arxiv
View SchemaExtension of the HF program to partially filled f-subshells
| Authors | G. Gaigalas, C. Froese Fischer |
|---|---|
| Categories | |
| ArXiv ID | physics/0406002 |
| URL | https://arxiv.org/abs/physics/0406002 |
| DOI | 10.1016/0010-4655(96)00092-6 |
| Journal | Comput. Phys. Commun. 98 (1996) 255-264 |
Abstract
A new version of a Hartree-Fock program is presented that includes extensions for partially filled f-subshells. The program allows the calculation of term dependent Hartree-Fock orbitals and energies in LS coupling for configurations with no more than two open subshells, including f-subshells.
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"abstract": "A new version of a Hartree-Fock program is presented that includes extensions\nfor partially filled f-subshells. The program allows the calculation of term\ndependent Hartree-Fock orbitals and energies in LS coupling for configurations\nwith no more than two open subshells, including f-subshells.",
"arxiv_id": "physics/0406002",
"authors": [
"G. Gaigalas",
"C. Froese Fischer"
],
"categories": [
"physics.atom-ph",
"physics.comp-ph"
],
"doi": "10.1016/0010-4655(96)00092-6",
"journal_ref": "Comput. Phys. Commun. 98 (1996) 255-264",
"title": "Extension of the HF program to partially filled f-subshells",
"url": "https://arxiv.org/abs/physics/0406002"
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