Orbit‐Orbit Molecular Integrals over Gaussian Orbitals
| avondale-bepress.context-key | 25941560 | |
| avondale-bepress.submission-path | sci_math_papers/140 | |
| avondale.faculty | Science | |
| avondale.reporting.isPeerReviewed | Peer Reviewed | |
| avondale.reporting.version | Published Version | |
| dc.contributor.author | Lo, Bruce W. N. | |
| dc.date.accessioned | 2023-11-01T00:34:17Z | |
| dc.date.available | 2023-11-01T00:34:17Z | |
| dc.date.issued | 1975-11-01 | |
| dc.date.submitted | 2021-11-16T16:39:03Z | |
| dc.description.abstract | <p>Analytical formulas are derived for integrals of the orbit‐orbit operator in the Breit‐Pauli Hamiltonian. The present method differs from an earlier one in the introduction of a new auxiliary function Gn(a) which is an integral of Shavitt's Fm(t) function. A method for its evaluation is discussed and some numerical examples are given. Copyright © 1975 John Wiley & Sons, Inc.</p> | |
| dc.identifier.citation | <p>Lo, B. W. N. (1975). Orbit‐orbit molecular integrals over Gaussian orbitals. <em>International Journal of Quantum Chemistry, 9</em>(6), 1055-1067. <a href="https://doi.org/10.1002/qua.560090612">https://doi.org/10.1002/qua.560090612</a></p> | |
| dc.identifier.doi | https://doi.org/10.1002/qua.560090612 | |
| dc.identifier.issn | 0020-7608 | |
| dc.identifier.uri | https://research.avondale.edu.au/handle/1897/25941560 | |
| dc.language.iso | en_us | |
| dc.relation.ispartof | International Journal of Quantum Chemistry | |
| dc.rights | <p>Due to copyright restrictions this article is unavailable for download.</p> | |
| dc.subject | integrals | |
| dc.subject | orbitals | |
| dc.subject | chemistry | |
| dc.title | Orbit‐Orbit Molecular Integrals over Gaussian Orbitals | |
| dc.type | Journal Article |