Hybrid orbitals and the runge–lenz vector
dc.contributor.author | Lohr, Lawrence L. Jr. | en_US |
dc.date.accessioned | 2006-04-28T16:33:45Z | |
dc.date.available | 2006-04-28T16:33:45Z | |
dc.date.issued | 1976-09 | en_US |
dc.identifier.citation | Lohr, Lawrence L. (1976)."Hybrid orbitals and the runge–lenz vector." International Journal of Quantum Chemistry 10(5): 799-809. <http://hdl.handle.net/2027.42/37972> | en_US |
dc.identifier.issn | 0020-7608 | en_US |
dc.identifier.issn | 1097-461X | en_US |
dc.identifier.uri | https://hdl.handle.net/2027.42/37972 | |
dc.description.abstract | Matrix elements of the Runge–Lenz vector A are presented for those linear combinations of degenerate hydrogenic functions often referred to as hybrid orbitals. The uncertainties in the components of A for each type of wave-function are related to the distribution of classical Kepler orbits corresponding to each function. Matrix elements of A with respect to radially nodeless Slater functions are presented, as these functions are often used as a basis set in atomic and molecular calculations. The properties of A for a piecewise Coulombic central field are discussed in relation to the description of penetrating orbits in the old quantum theory. Simultaneous eigenfunctions of A and the Hamiltonian cannot be chosen for the piecewise Coulombic field because of a discontinuity in the radial derivative of the potential energy. | en_US |
dc.format.extent | 572696 bytes | |
dc.format.extent | 3118 bytes | |
dc.format.mimetype | application/pdf | |
dc.format.mimetype | text/plain | |
dc.language.iso | en_US | |
dc.publisher | John Wiley & Sons, Inc. | en_US |
dc.subject.other | Computational Chemistry and Molecular Modeling | en_US |
dc.subject.other | Atomic, Molecular and Optical Physics | en_US |
dc.title | Hybrid orbitals and the runge–lenz vector | en_US |
dc.type | Article | en_US |
dc.rights.robots | IndexNoFollow | en_US |
dc.subject.hlbsecondlevel | Chemical Engineering | en_US |
dc.subject.hlbsecondlevel | Chemistry | en_US |
dc.subject.hlbsecondlevel | Materials Science and Engineering | en_US |
dc.subject.hlbtoplevel | Engineering | en_US |
dc.subject.hlbtoplevel | Science | en_US |
dc.description.peerreviewed | Peer Reviewed | en_US |
dc.contributor.affiliationum | Department of Chemistry, University of Michigan, Ann Arbor, Michigan 48109, USA | en_US |
dc.description.bitstreamurl | http://deepblue.lib.umich.edu/bitstream/2027.42/37972/1/560100511_ftp.pdf | en_US |
dc.identifier.doi | http://dx.doi.org/10.1002/qua.560100511 | en_US |
dc.identifier.source | International Journal of Quantum Chemistry | en_US |
dc.owningcollname | Interdisciplinary and Peer-Reviewed |
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