170 Poster session, J7Quantum-classical Rydberg electron dynamics in a polar moleculeP. John Shepherd 1 , Vladislav E. Chernov 2,3 , Dmitry L. Dorofeev 3 , M.Yu. Knyazev 31 School of <strong>Ph</strong>ysics, University of Exeter, Stocker Road, Exeter, UK, EX4 4QL,p.j.shepherd@exeter.ac.uk; 2 J.Heyrovský Institute of Chemical <strong>Ph</strong>ysic, Praha 8,Dolejškova 3, 18200, chernov@jh-inst.cas.cz; 3 Voronezh State University, Voronezh394006, Russia, e-mail: chernov@niif.vsu.ruShepherd P.J.Chernov V.E.Dorofeev D.L.Knyazev M.Yu.The classical picture of the coupling between the electronic and rotational degrees offreedom for molecular Rydberg states has proved effective in the analysis of a wide rangeof phenomena, such as chaotic auto-ionization of molecular Rydberg states [1] and timeevolution of Rydberg wave packets [2]. The quantum description of a Rydberg electron ina polar molecule is based on the exactly solvable [3] “Coulomb + point dipole”Hamiltonian. Besides the projection of the electron orbital angular momentum on to thedipole axis, the noninteger quasi-angular momentum l , ( d) l l, ( d), wherel, ( d)is the quantum defect), is the conserved quantum number appearing in the2 2eigenvalue ( 1)of the nonspherical operator L 2dcoswith eigenvaluesenumerated by the integer l. The classical Hamiltonian can be written in terms of the actionvariables as2 21( I I) 3I2Hel 2Ir I I , ( d) 2 ,where, for small d, , ( d)d is the54( I I)classical counterpart of the quantum defect l, ( d). It is remarkable that for small d theycoincide for large (quasiclassical) I I[3].The dynamics of very high Rydberg states displays rotational–electronic nonadiabaticinteractions (l-decoupling [4], or inverse Born–Oppenheimer dynamics corresponding totransition from Hund cases a, b to case d [5]). The criterion for breakdown of the rotationalBorn–Oppenheimer approximation is the same in the quantum and the classical picture: thecore rotation frequency B N should be high compared with the precession frequency p(not with the Keplerian frequency K ), i.e., the rotational l-decoupling can occur at2effective quantum numbers 1 3* Δ Z B N , where Δ l 1, l, . Sincethe quantum defects of high-l Rydberg levels are small, the * values can be lower thanthose often used [4,5] when one assumes Δ 1.References[1] F. Benvenuto, G. Casati, D. L. Shepelyansky, <strong>Ph</strong>ys. Rev. Lett. 72, 1818 (1994)[2] H. H. Fielding, Ann. Rev. <strong>Ph</strong>ys. Chem. 56, 91 (2005)[3] B. A. Zon, Zh. Eksp. Teor. Fiz. 102, 36 (1992) [Sov. <strong>Ph</strong>ys. JETP 75, 19 (1992)]; J. K.G. Watson, Mol. <strong>Ph</strong>ys. 81, 227 (1994)[4] R. W. Field, C.M. Gittins, N. A. Harris, Ch. Jungen, J. Chem. <strong>Ph</strong>ys. 122, 184314(2005)[5] B. A. Zon, <strong>Ph</strong>ys. Lett. A203, 373 (1995); A.V. Danilyan, V.E. Chernov, Opt.Spectrosc. 104, 21 (2008)
Poster session, J8 171CO 2 broadening and shift coefficients for the 2–0 band of COand influence on the inversion of SOIR spectraM. Tudorie, 1 S. Robert, 2 T. Földes, 1 A. Mahieux, 2 R. Drummond, 2V. Wilquet, 2 A. C. Vandaele 2 and J. Vander Auwera 11 Service de Chimie Quantique et <strong>Ph</strong>otophysique, C.P. 160/09, Université Libre deBruxelles, 50 avenue F.D. Roosevelt, B-1050 Brussels, Belgium, jauwera@ulb.ac.be;2 Planetary Aeronomy Division, Belgian Institute for Space Aeronomy, 3 AvenueCirculaire, B-1180 Brussels, Belgium, severine.robert@aeronomie.beCarbon monoxide is present in the atmosphere of Venus and Mars, as observed for thefirst time by Connes et al. 1 and Kaplan et al., 2 respectively. More recent CO spectrawere recorded in the 2.2 and 4.3 μm region 3,4 by the SOIR (Solar Occultation in theInfraRed) instrument onboard the ESA Venus Express spacecraft 5 and by the PFS(Planetary Fourier Spectrometer) instrument onboard the ESA Mars Expressspacecraft. 6 As carbon dioxide is the predominant species in these atmospheres,retrievals of CO concentrations from SOIR spectra require knowledge of CO 2broadening and shift coefficients 7 and their temperature dependence.We recorded spectra of CO/CO 2 mixtures at 284, 272, 255 and 240 K and totalpressures between 120 and 900 Torr, using a Bruker IFS125HR Fourier transformspectrometer. We measured CO 2 pressure broadening and shift coefficients of lines inthe 2–0 band of CO near 2.3 μm, using a multi-spectrum non-linear least squares fittingprocedure. 8 The analysis put forward the necessity to consider speed dependenceeffects, and possibly line mixing effects, on the Voigt profile.With a resolution of 0.12 cm –1 , the highest onboard Venus Express, SOIR may besensitive enough to study line profiles. The line broadening parameters measured in thepresent work have been used to fit SOIR spectra with the ASIMAT code. 9 The results interms of retrieved densities and temperatures will be compared with those obtainedusing HITRAN2008. 10Tudorie M.Robert S.Foldes T.Mahieux A.Drummond R.Wilquet V.Vandaele A.C.Vander Auwera J.References[1] P. Connes, J. Connes, L.D. Kaplan, W.S. Benedict, Astrophys. J. 152, 731, 1968.[2] L.D. Kaplan, J. Connes, P. Connes, Astrophys. J. 157, L187, 1969.[3] J.L. Bertaux, A.C. Vandaele et al., Nature 450, 646, 2007.[4] A.C. Vandaele, M. De Mazière et al., J. Geophys. Res. 113, E00B23, 2008.[5] D. Nevejans, E. Neefs et al., Appl. Opt. 45, 5191, 2006.[6] G. Sindoni, V. Formisano, A. Geminale, Planet. Space Sci. 59, 149, 2011.[7] K. Sung and P. Varanasi, JQSRT 91, 319, 2005.[8] M. Tudorie, T. Földes, A.C. Vandaele, J. Vander Auwera, JQSRT 113, 1092, 2012.[9] A. Mahieux, A.C. Vandaele et al., J. Geophys. Res. 115, E12014, 2010.[10] L.S. Rothman, I. Gordon et al., JQSRT 110, 533, 2009.AcknowledgmentsFinancial support from the Fonds de la Recherche Scientifique (F.R.S.-FNRS, Belgium,contract FRFC), the Action de Recherches Concertées of the Communauté française deBelgique, the Belgian Federal Science Policy Office (contract SD/CS/07A, AdvancedExploitation of Ground-Based Measurements for Atmospheric Chemistry and Climateapplications – II), and the European Space Agency (ESA, PRODEX program, contracts C90268, 90113, and 17645) is gratefully acknowledged.
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Book of abstractsof the 22 th Inter
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CommitteesLocal Organizing committe
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Table of contentProgram of sessions
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8 Program of sessionsInvited Lectur
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10 Program of sessionsD6 Tasinato N
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22 Program of sessionsJ8 Tudorie M.
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26 Program of sessionsIoannes Marcu
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28 Program of sessionsContributed L
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Invited LecturesASeptember 4, Tuesd
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40 Contributed Lectures, B5Laborato
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48 Poster session, D1Spectroscopic
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50 Poster session, D3Ab-initio norm
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52 Poster session, D5The 2 and 4
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56 Poster session, D9The stretching
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78 Poster session, D31Coriolis Anal
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80 Poster session, D33Symmetric gro
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86 Poster session, D39Low-energy vi
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88 Poster session, D41New progress
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114 Poster session, H1Computation o
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116 Poster session, H3Rotationally-
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118 Poster session, H5The Rotationa
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234 Author indexAAbdelghany A. —
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240 Author indexKhelkhal M. — D29
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242 Author indexMartin M.A. — D31
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246 Author indexSzajna W. — H29,
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248 Author indexZamotaeva V.A. —
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250 EmailsAbdelghany A.Abdelghany A
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252 EmailsGuarnieri A.ag@tf.uni-kie
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254 EmailsMichaut X.Xavier.Michaut@
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256 EmailsTyuterev Vl.G.vladimir.ti
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FT-IR spectrometerIFS 125HROutstand
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32nd International Symposium on Fre
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Some more information
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Addresses:Conference Site: National