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H2, HD, and D2 in the small cage of structure II clathrate hydrate: Vibrational frequency shifts from fully coupled quantum six-dimensional calculations of the vibration-translation-rotation eigenstates.

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Title: H2, HD, and D2 in the small cage of structure II clathrate hydrate: Vibrational frequency shifts from fully coupled quantum six-dimensional calculations of the vibration-translation-rotation eigenstates.
Authors: Lauvergnat D; Laboratoire de Chimie Physique, UMR-CNRS 8000, Université de Paris-Sud, Orsay F-91405, France., Felker P; Department of Chemistry and Biochemistry, University of California, Los Angeles, California 90095-1569, USA., Scribano Y; Laboratoire Univers et Particules de Montpellier, Université de Montpellier, UMR-CNRS 5299, 34095 Montpellier Cedex, France., Benoit DM; Department of Physics and Mathematics, E.A. Milne Centre for Astrophysics and G. W. Gray Centre for Advanced Materials, The University of Hull, Cottingham Road, Kingston upon Hull HU6 7RX, United Kingdom., Bačić Z; Department of Chemistry, New York University, New York, New York 10003, USA.
Source: The Journal of chemical physics [J Chem Phys] 2019 Apr 21; Vol. 150 (15), pp. 154303.
Publication Type: Journal Article
Journal Info: Publisher: American Institute of Physics Country of Publication: United States NLM ID: 0375360 Publication Model: Print Cited Medium: Internet ISSN: 1089-7690 (Electronic) Linking ISSN: 00219606 NLM ISO Abbreviation: J Chem Phys Subsets: PubMed not MEDLINE
Database: MEDLINE Ultimate
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  Data: <searchLink fieldCode="AU" term="%22Lauvergnat+D%22">Lauvergnat D</searchLink>; Laboratoire de Chimie Physique, UMR-CNRS 8000, Université de Paris-Sud, Orsay F-91405, France.<br /><searchLink fieldCode="AU" term="%22Felker+P%22">Felker P</searchLink>; Department of Chemistry and Biochemistry, University of California, Los Angeles, California 90095-1569, USA.<br /><searchLink fieldCode="AU" term="%22Scribano+Y%22">Scribano Y</searchLink>; Laboratoire Univers et Particules de Montpellier, Université de Montpellier, UMR-CNRS 5299, 34095 Montpellier Cedex, France.<br /><searchLink fieldCode="AU" term="%22Benoit+DM%22">Benoit DM</searchLink>; Department of Physics and Mathematics, E.A. Milne Centre for Astrophysics and G. W. Gray Centre for Advanced Materials, The University of Hull, Cottingham Road, Kingston upon Hull HU6 7RX, United Kingdom.<br /><searchLink fieldCode="AU" term="%22Bačić+Z%22">Bačić Z</searchLink>; Department of Chemistry, New York University, New York, New York 10003, USA.
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  Data: <searchLink fieldCode="JN" term="%220375360%22">The Journal of chemical physics</searchLink> [J Chem Phys] 2019 Apr 21; Vol. 150 (15), pp. 154303.
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        Value: 10.1063/1.5090573
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              Text: 2019 Apr 21
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