| Literature DB >> 24320246 |
Li-juan Fu1, Antonio Rizzo, Juha Vaara.
Abstract
New, high-sensitivity and high-resolution spectroscopic and imaging methods may be developed by exploiting nuclear magneto-optic effects. A first-principles electronic structure formulation of nuclear electric quadrupole moment-induced Cotton-Mouton effect (NQCME) is presented for closed-shell atoms. In NQCME, aligned quadrupole moments alter the index of refraction of the medium along with and perpendicular to the direction of nuclear alignment. The roles of basis-set convergence, electron correlation, and relativistic effects are investigated for three quadrupolar noble gas isotopes: (21)Ne, (83)Kr, and (131)Xe. The magnitude of the resulting ellipticities is predicted to be 10(-4)-10(-6) rad/(M cm) for fully spin-polarized nuclei. These should be detectable in the Voigt setup. Particularly interesting is the case of (131)Xe, in which a high degree of spin polarization can be achieved via spin-exchange optical hyperpolarization.Entities:
Year: 2013 PMID: 24320246 DOI: 10.1063/1.4830094
Source DB: PubMed Journal: J Chem Phys ISSN: 0021-9606 Impact factor: 3.488