An Investigation of the Energy Levels of the Pt2+ Ion Using Multi-Reference Spin-Orbit Configuration Interaction Theory

dc.contributor.advisor	Ermler, Walter C.
dc.contributor.author	Belmares, Jacob Gray
dc.contributor.committeeMember	Xu, Fang
dc.contributor.committeeMember	Frederick, John
dc.date.accessioned	2024-02-09T19:26:59Z
dc.date.available	2024-02-09T19:26:59Z
dc.date.issued	2022
dc.description.abstract	This project sought to obtain more info for NIST's Atomic Spectra Database (ASD) by generating energies of the Pt<sup>2+</sup> ion, whose current data is sparse. We used the COLUMBUS suite of codes to perform this task and calculated the energy levels and transition moments of Pt<sup>2+</sup> under various symmetries using multi-reference spin-orbit configuration interaction calculations.
dc.description.department	Chemistry
dc.format.extent	49 pages
dc.format.mimetype	application/pdf
dc.identifier.isbn	9798438751618
dc.identifier.uri	https://hdl.handle.net/20.500.12588/2841
dc.language	en
dc.subject	Energy levels
dc.subject	Platinum
dc.subject	Spin-orbit configuration interaction theory
dc.subject.classification	Computational chemistry
dc.subject.classification	Particle physics
dc.subject.classification	Atomic physics
dc.subject.classification	Chemistry
dc.title	An Investigation of the Energy Levels of the Pt2+ Ion Using Multi-Reference Spin-Orbit Configuration Interaction Theory
dc.type	Thesis
dc.type.dcmi	Text
dcterms.accessRights	pq_closed
thesis.degree.department	Chemistry
thesis.degree.grantor	University of Texas at San Antonio
thesis.degree.level	Masters
thesis.degree.name	Master of Science

Files

Now showing 1 - 1 of 1