Excited states of lutetium oxide and its singly charged cation

Author:

Wu Lu1,Schoendorff George23ORCID,Zhang Yuchen1,Roudjane Mourad1,Gordon Mark S.2ORCID,Yang Dong-Sheng1ORCID

Affiliation:

1. Department of Chemistry, University of Kentucky, Lexington, Kentucky 40506-0055, USA

2. Department of Chemistry, Iowa State University, Ames, Iowa 50011-3111, USA

3. Propellants Branch, Rocket Propulsion Division, Aerospace Systems Directorate, Air Force Research Laboratory, AFRL/RQRP, Edwards Air Force Base, California 93524, USA

Abstract

Vibronic spectra of lutetium oxide (LuO) seeded in supersonic molecule beams are investigated with mass-analyzed threshold ionization (MATI) spectroscopy and second-order multiconfigurational quasi-degenerate perturbation (MCQDPT2) theory. Six states of LuO and four states of LuO+ are located by the MCQDPT2 calculations, and an a3Π(LuO+) ← C2Σ+ (LuΟ) transition is observed by the MATI measurement. The vibronic spectra show abnormal vibrational intervals for both the neural and cation excited states, and the abnormality is attributed to vibrational perturbations induced by interactions with neighboring states.

Funder

U.S. Department of Energy

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference44 articles.

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