Literature DB >> 26093543

Communication: The ground electronic state of Si2C: Rovibrational level structure, quantum monodromy, and astrophysical implications.

Neil J Reilly1, P Bryan Changala2, Joshua H Baraban3, Damian L Kokkin1, John F Stanton4, Michael C McCarthy1.   

Abstract

We report the gas-phase optical detection of Si2C near 390 nm and the first experimental investigation of the rovibrational structure of its (1)A1 ground electronic state using mass-resolved and fluorescence spectroscopy and variational calculations performed on a high-level ab initio potential. From this joint study, it is possible to assign all observed Ka = 1 vibrational levels up to 3800 cm(-1) with confidence, as well as a number of levels in the Ka = 0, 2,  and 3 manifolds. Dixon-dip plots for the bending coordinate (ν2) allow an experimental determination of a barrier to linearity of 783(48) cm(-1) (2σ), in good agreement with theory (802(9) cm(-1)). The calculated (Ka, ν2) eigenvalue lattice shows an archetypal example of quantum monodromy (absence of a globally valid set of quantum numbers) that is reflected by the experimentally observed rovibrational levels. The present study provides a solid foundation for infrared and optical surveys of Si2C in astronomical objects, particularly in the photosphere of N- and J-type carbon stars where the isovalent SiC2 molecule is known to be abundant.

Entities:  

Year:  2015        PMID: 26093543     DOI: 10.1063/1.4922651

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  2 in total

1.  Building Blocks of Dust: A Coordinated Laboratory and Astronomical Study of AGB Stars.

Authors:  Michael C McCarthy; Carl A Gottlieb; Jose Cernicharo
Journal:  J Mol Spectrosc       Date:  2019-02       Impact factor: 1.507

2.  IRC +10216 as a spectroscopic laboratory: improved rotational constants for SiC2, its isotopologues, and Si2C.

Authors:  J Cernicharo; M Guélin; M Agúndez; J R Pardo; S Massalkhi; J P Fonfría; L Velilla Prieto; G Quintana-Lacaci; N Marcelino; C Marka; S Navarro; C Kramer
Journal:  Astron Astrophys       Date:  2018-10-03       Impact factor: 5.802

  2 in total

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