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Title: Pulsed-nozzle Fourier-transform microwave spectroscopy of laser-vaporized metal oxides: Rotational spectra and electric dipole moments of YO, LaO, ZrO, and HfO

Journal Article · · Journal of Chemical Physics; (USA)
DOI:https://doi.org/10.1063/1.457690· OSTI ID:6837279
; ; ;  [1]
  1. Molecular Physics Division, National Institute of Standards and Technology, Gaithersburg, Maryland 20899 (USA)

The rotational spectra of YO, LaO, ZrO, and HfO have been measured using a Fourier-transform microwave spectrometer in combination with a laser-ablation source. Here, a {ital Q}-switched Nd:YAG laser (532 nm) was used to vaporize the metal oxides from a target source rod located in the throat of a pulsed-molecular-beam valve. A description of the instrument is given. The electric dipole moments of the four species have been measured and compared to {ital ab} {ital initio} results, where available. The experimental values are {mu}{sub YO} =4.524(7), {mu}{sub LaO} =3.207(11), {mu}{sub ZrO} =2.551(11), and {mu}{sub HfO} =3.431(5) D. Of special note are the extremely large nuclear quadrupole coupling constants, eQq, determined for the {sup 177}HfO and {sup 179}HfO isotopic species, with values of {minus}5952.649(35) MHz and {minus}6726.981(39) MHz, respectively. This is the first determination of nuclear quadrupole coupling constants for a molecule containing the Hf atom.

OSTI ID:
6837279
Journal Information:
Journal of Chemical Physics; (USA), Vol. 92:8; ISSN 0021-9606
Country of Publication:
United States
Language:
English

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