TF. THEORY

TUESDAY, JUNE 17, 2003 - 1:30PM

Room: 1009 SMITH LAB

Chair: GYÖRGY TARCZAY, The Ohio State University, Columbus, OH

TF01 15min1:30
BODY-FRAME COHERENCES AND ROTATIONAL-ELECTRONIC WAVE-PACKET DYNAMICS OF CAF IN NON-PENETRATING RYDBERG STATES.

SERHAN N. ALTUNATA AND ROBERT W. FIELD, Department of Chemistry, Massachusetts Institute of Technology, Cambridge MA 02139.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]    Archived Digital Presentation:  [PPT] [GIFS]

TF02 15min1:47
STATES AND TRANSITION IN FLOPPY COUPLED ROTOR MODELS.

HORACE T. CROGMAN AND WILLIAM G. HARTER, Department of Physics,University Of Arkansas, Fayetteville, AR 72701.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]

TF03 15min2:04
HOW UNDISTINGUISHED? SPIN, PERMUTATION SYMMETRY, AND SPECTRAL EXCLUSION IN COUPLED ROTOR SYSTEMS .

WILLIAM G. HARTER AND HORACE T. CROGMAN, Department of Physics,University Of Arkansas, Fayetteville, AR 72701.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]

TF04 15min2:21
QUANTUM VOICEPRINTS : WAVE DECOHERENCE AND REVIAL IN MODEL ROTOR SYSTEM AND LEVEL CLUSTER DYNAMICS.

DAVID NORRIS AND WILLIAM G. HARTER, Department of Physics,University Of Arkansas, Fayetteville, AR 72701.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]

TF05 15min2:38
MIXED QUANTUM/CLASSICAL APPROACH TO PHOTODISSOCIATION OF \chemH2O AND \chemAr-H2O.

FENG CHEN AND ANNE B. MCCOY, Department of Chemistry, The Ohio State University, Columbus, OH 43210.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]

TF06 15min2:55
EVOLUTION OF MOLECULAR ELECTRIC DIPOLE MOMENT UPON VIBRATIONAL EXCITATION..

PATRICE THEULÉ, ANDREA CALLEGARI AND THOMAS R. RIZZO, Laboratoire de Chimie Physique Moléculaire (LCPM), Ecole Polytechnique Fédérale de Lausanne, CH-1015 Lausanne, Switzerland; JOHN S. MUENTER, Dept. of Chemistry, University of Rochester, Rochester, NY 14627.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]    Archived Digital Presentation:  [PPT] [GIFS]

INTERMISSION

TF07 15min3:30
THE SYMMETRIZATION OF ANGULAR MOMENTUM WAVEFUNCTIONS AND ITS APPLICATIONS TO MOLECULAR SPECTROSCOPY.

V. BOUDON, M. REY, CH. WENGER, G. PIERRE, Laboratoire de Physique de l'Université de Bourgogne, CNRS UMR 5027, 9, Avenue Alain Savary, BP 47870, F-21078 Dijon Cedex, France; B. SARTAKOV, General Physics Institute RAS, Vavilov str. 38, 119991 Moscow, Russia.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]    Archived Digital Presentation:  [PPT] [GIFS]

TF08 15min3:47
INDETERMINACIES IN DIATOMIC BORN-OPPENHEIMER CORRECTIONS, WITH AN APPLICATION TO THE FITTING OF LiH DATA.

JAMES K. G. WATSON, Steacie Institute for Molecular Sciences, National Research Council of Canada, Ottawa, Ontario, Canada K1A 0R6.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]

TF09 15min4:04
APPLICATION OF THE GENETIC ALGORITHM IN THE ANALYIS OF COMPLEX MOLECULAR SPECTRA.

W. LEO MEERTS, Department of Molecular and Laser Physics, University of Nijmegen, P.O. Box 9010, 6500 GL Nijmegen, The Netherlands; MICHAEL SCHMITT, Institut für Physikalische Chemie I, Heinrich-Heine-Universität, Universitätsstrasse 26.43.02, D-40225 Düsseldorf, Germany; GERRIT. C. GROENENBOOM, Institute of Theoretical Chemistry, University of Nijmegen, P.O. Box 9010, 6500 GL Nijmegen, The Netherlands.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]    Archived Digital Presentation:  [PPT] [GIFS]

TF10 10min4:21
ANOMALOUS ISOTOPIC EFFECT IN THE H-Xe STRETCHING FREQUENCY OF HXeOH.

H.-G. YU, J. T. MUCKERMAN, Department of Chemistry, Brookhaven National Laboratory, Upton, NY 11973-5000, USA.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]    Archived Digital Presentation:  [PPT] [GIFS]

TF11 15min4:33
AB INITIO ANHARMONIC FORCE FIELS AND EQUILIBRIUM STRUCTURE OF CARBONYL CHLOROFLUORIDE.

J. DEMAISON, Laboratoire PhLAM, CNRS, Université de Lille I, Bat. P5, 59655 Villeneuve d'Ascq Cedex, France; A. PERRIN, Laboratoire de Photophysique Moléculaire, CNRS, Université Paris Sud, Campus d'Orsay, Bât. 350, 91405 Orsay Cedex, France; H. BÜRGER, FB 9 - Anorganische Chemie - Universität , D-42097 Wuppertal, Germany.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]    Archived Digital Presentation:  [PPT] [GIFS]

TF12 15min4:50
DEUTERATED PROPANAL FIR SPECTRUM .

M. VILLA, Departamento de Quimica (CBI, UAM-I). Av. San Rafael Atlixco 186, Col. Vicentina, Iztapalapa 09340, Mexico D.F., MEXICO; M. L. SENENT, Instituto de Estructura de la Materia (C.S.I.C.), Serrano 113bis, Madrid, SPAIN.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]

TF13 15min5:07
ON THE METHYL INTERNAL ROTATION PROBLEM.

ATTILA G. CSÁSZÁR, Department of Theoretical Chemistry, Eötvös University, P. O. Box 32, H-1518 Budapest 112, Hungary; VIKTOR SZALAY, Crystal Physics Laboratory, Research Institute for Solid State Physics and Optics, Hungarian Academy of Sciences, P. O. Box 49, H-1525 Budapest, Hungary.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]

TF14 15min5:24
SPECTROSCOPY OF X2Y4 (D2h) MOLECULES: TENSORIAL FORMALISM ADAPTED TO THE \mathbfO(3) \supset D2h CHAIN, HAMILTONIAN AND TRANSITION MOMENT OPERATORS. APPLICATION TO THE nu12 and nu2 BANDS OF C2H4..

M. ROTGER, W. RABALLAND, V. BOUDON AND M. LOËTE, Laboratoire de Physique de l'Université de Bourgogne, UMR CNRS 5027, 9, Avenue Alain Savary, B.P. 47 870, F-21078 DIJON Cedex, France.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]    Archived Digital Presentation:  [PPT] [GIFS]

TF15 15min5:41
THE GROUND STATE ROTATIONAL SPECTRUM OF SO2F2..

M. ROTGER, V. BOUDON AND M. LOËTE, Laboratoire de Physique de l'Université de Bourgogne, CNRS UMR 5027, 9, Avenue Alain Savary, B.P. 47 870, F-21078 DIJON Cedex, France; L. MARGULÈS AND J. DEMAISON, Laboratoire de Physique, Atomes et Molécules, CNRS UMR 8523, Université de Lille I, Bât. P5, 59655 Villeneuve d'Ascq Cedex, France; H. MÄDER, Institut für Physikalische Chemie, Universität Kiel, Olshausenstr. 40, D-24098 KIEL Germany; G. WINNEWISSER AND H. S. P. MÜLLER, I. Physikalisches Institut, Universität zu Köln, D-50937 KÖLN Germany.

Abstract:  [HTML] [GIF] [PS] [PDF] [DVI]    Archived Digital Presentation:  [PPT] [GIFS]

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