Infrared spectrum of H 5 + and D 5 +: The simplest shared-proton model
Entity
UAM. Departamento de Química Física AplicadaPublisher
American Physical SocietyDate
2011-12-19Citation
10.1103/PhysRevA.84.060502
Physics review A 84.6 (2011): 060502
ISSN
1050-2947 (print); 1094-1622 (online)DOI
10.1103/PhysRevA.84.060502Funded by
This work has been supported by the Consolider-Ingenio 2010 Programme CSD2009-00038 (MICINN), MICINN Grant No. FIS2010-18132, and CAM Grant No. S-2009/MAT/1467. P.B. acknowledges support from the “Fundación Ramón Areces.” The aid of COST Action CM1002 (CODECS) is also appreciatedProject
Gobierno de España. CSD2009-00038; Gobierno de España. FIS2010-18132; Comunidad de Madrid. S2009/MAT-1467/NANOOBJETOSEditor's Version
http://dx.doi.org/10.1103/PhysRevA.84.060502Subjects
QuímicaRights
© 2011 American Physical SocietyAbstract
We present a two-dimensional collinear, adiabatic model to describe the motion of a proton in between two hydrogen molecules which adjust their elongation to trace a minimum-energy path. Together with bound states, the predissociative, vibrationally excited states involved in the electric dipole transitions are characterized. The main qualitative features of the infrared spectra of H5 + and its deuterated variant are discussed, and the effect of the temperature of the clusters is analyzed
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Google Scholar:Sanz Sanz, Cristina
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Roncero, Octavio
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Valdés, Alvaro
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Prosmiti, Rita
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Delgado-Barrio, Gerardo
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Villarreal, Pablo
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Barragán, Patricia
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Aguado Gómez, Alfredo
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