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H I T R A The 9th HITRAN N Database Conference HARVARD-SMITHSONIAN CENTER FOR ASTROPHYSICS CAMBRIDGE MA, USA 2006 26 -28 June 2006 CONFERENCE PROGRAM 14:30 Temperature Dependence of N2-, O2-, and Air- 13:30 THz Studies of Water Vapor D. F. Plusquellic Broadened Half-Widths of Water Vapor Tran- 14:00 HDO and D O Long Path Spectroscopy: DAY 1, Monday 26 June sitions: Insight from Theory and Comparison 2 On-Going Work of the Brussels-Reims Team with Measurement . R. R. Gamache 7:30 Registration L. Daumont 15:00 Modi¯cations of the Robert-Bonamy Formal- 14:30 Air Broadened Ozone Linewidths in the Sub- 9:00 WELCOME . Laurence S. Rothman ism and Further Re¯nements Required.Q. Ma millimeter Wavelengths . Brian Drouin 9:10 KEYNOTE . Stephen S. Murray 15:30 Using Laboratory FT-IR Spectrometer Mea- 15:00 A complete set of line parameters for CH3Br surements and HITRAN to Derive the Pure in the 10-¹m spectral region. .D. Jacquemart SESSION 1: Laboratory Water Vapour Continuum Between 3000 cm¡1 ¡1 Spectroscopy and 8000 cm . David Paynter 15:30 High Resolution Assignment of º14 and º16 Bands in the 10 ¹m for Trans-AcroleinL.-H. Xu 16:00-18:00 POSTER SESSION 1 9:30 The Quest for Consistency and Accuracy 16:00-18:00 POSTER SESSION 2 of Spectroscopic Parameters in HITRAN: 19:00 Dinner, Inn at Harvard Bridge between Archive and Application Laurence S. Rothman DAY 3, Wednesday 28 June DAY 2, Tuesday 27 June 10:00 Diode- and Di®erence-Frequency Laser Stud- SESSION 5: Databases ies of Atmospheric Molecules in the Near- SESSION 3: Remote Sensing and Mid-infrared: H2O, NO2, and NH3 9:00 Recent Developments in the Cologne Database Johannes Orphal 9:00 What about the Spectral Parameters when for Molecular Spectroscopy, CDMS, and the Need for Further Laboratory Spectroscopic 10:30 Water Pressure Broadening: A Never-ending Performing Synergistic Atmospheric Measure- Data . H. S. P. MÄuller Story . Georg Wagner ments? . J.-M. Flaud 11:00 Co®ee Break 9:30 Assessment of the GEISA and GEISA/IASI- 9:30 Linelist Needs for the Atmospheric Chem- 03 Spectroscopic Data Quality: through Com- 11:15 Analysis of High Resolution Infrared CW- istry Experiment . C. D. Boone parisons with Other Public Database Archives ¡1 CRDS Spectra of Ozone in the 6000-6750 cm N. Jacquinet-Husson Spectral Region . A. Barbe 10:00 CO2 Spectroscopy Evaluation Using FTS Spec- tra . B. Sen 10:00 A Comprehensive Database for Water Spectra 11:45 Relief is on the Way: Status of the Line Posi- Jonathan Tennyson tions and Intensities for Nitric Acid . A. Perrin 10:30 Co®ee Break 10:30 Co®ee Break 12:15 Lunch Served 11:00 Infrared Laboratory Spectroscopy of CH4 and CH3D for Atmospheric Remote Sensing 10:45 New Cross Sections, Indices of Refraction, and SESSION 2: Theory Linda R. Brown Reflectance Spectra of Atmospheric Interest S. Massie 11:30 Spectroscopic Parameter Requirements 13:30 The Water Molecule: Line Position and Line for Remote Sensing of Terrestrial Planets 11:15 MolExplorer: A New Tool for Computation Intensity Analyses up to the Second Triad Mary Ann H. Smith and Display of Spectra from the HITRAN Laurent H. Coudert Database . H. Harde 12:00 Lunch Served 14:00 Global Frequency and Infrared Intensity 11:45 First De¯nition and Implementation of Stan- 12 Analysis of CH4 Lines in the 900{4800 dards for the Exchange of Atomic and Molec- cm¡1 Region . V.Boudon SESSION 4: Laboratory Spectroscopy ular Data . M.L. Dubernet DAY 1, Monday 26 June SESSION 1: Laboratory Spectroscopy 1 The Quest for Consistency and Accuracy of Spectroscopic Parameters in HITRAN: Bridge between Archive and Application Laurence S. Rothman ............................. 2 Diode- and Di®erence-Frequency Laser Studies of Atmospheric Molecules in the Near- and Mid-infrared: H2O, NO2, and NH3 Johannes Orphal, Pascale Chelin, Pierre-Marie Flaud, and Nofal Ibrahim . 3 Water Pressure Broadening: A Never-ending Story Georg Wagner, Manfred Birk .......................... 4 Analysis of High Resolution Infrared CW-CRDS Spectra of Ozone in the 6000-6750 cm¡1 Spectral Region A. Barbe, M.R. De Backer-Barilly, Vl.G. Tyuterev, D. Romanini, S. Kassi, A.Campargue .................................. 5 Relief is on the Way: Status of the Line Positions and Intensities for Nitric Acid A. Perrin, J.-M. Flaud, J. Orphal, F. Mencaraglia, G. Bianchini, A. Boscaleri, B. Carli,Ceccherini, P. Raspollini, G. Brizzi, M. Carlotti, M. Ridol¯ . 6 SESSION 2: Theory 7 The Water Molecule: Line Position and Line Intensity Analyses up to the Second Triad Laurent H. Coudert, Georg Wagner, Manfred Birk, and Jean-Marie Flaud . 8 12 Global Frequency and Infrared Intensity Analysis of CH4 Lines in the 900{4800 cm¡1 Region A. Nikitin, V.Boudon, J.-P. Champion, S. Albert, S. Bauerecker, M. Quack, L. R. Brown .................................... 9 Temperature Dependence of N2-, O2-, and Air-Broadened Half-Widths of Water Vapor Transitions: Insight from Theory and Comparison with Measurement R. R. Gamache, B. K. Antony, P. R. Gamache, G. Wagner, M. Birk . 10 Modi¯cations of the Robert-Bonamy Formalism and Further Re¯nements Required Q. Ma, R. H. Tipping, C. Boulet ........................ 11 Using Laboratory FT-IR Spectrometer Measurements and HITRAN to Derive the Pure Water Vapour Continuum Between 3000 cm¡1 and 8000 cm¡1 David Paynter, Keith Shine, Kevin Smith ................... 12 i Poster Session 1 13 1.1 Water Line Parameters from Re¯tted Spectra Using a New Fitting Tech- nique R. N. Tolchenov, J. Tennyson ......................... 14 16 17 18 1.2 Labeling of H2 O, H2 O and H2 O Synthetic Line Lists in the 0 { 26000 cm¡1 Range N.F. Zobov, R.I. Ovsyannikov, S.V. Shirin, O.L. Polyansky . 15 1.3 The Experimental Investigation of the Water Vapor Discrete and Contin- uum Absorption in the 8 to 12 ¹m Region at Temperatures from 311 K to 352 K Yu. I. Baranov, W. J. La®erty ......................... 16 1.4 Measurement and Analysis of High Resolution Terahertz Spectra of HDO and D2O S. BrÄunken, H. S. P. MÄuller,C. P. Endres, F. Lewen, T. F. Giesen, H. MÄader, J. C. Pearson, B. J. Drouin .......................... 17 1.5 A New \Diet" For Air-Broadened Half-Widths of Water Vapor in the HITRAN2004 Compilation I. E. Gordon, L. S. Rothman, D. Jacquemart, R. R. Gamache . 18 1.6 High-Precision Measurements of H2O Line Intensities and Broadening Coe±cients Using Frequency-Stabilized Cavity Ring-Down Spectroscopy Joseph T. Hodges, Daniel Lisak ........................ 19 ¡1 1.7 Line Mixing in Pure CO2 Absorption at 6348 cm C. E. Miller, L. R. Brown, R. A. Toth, D. C. Benner, M. Devi, M. Dulick . 20 1.8 Theoretical Studies of the Wet Continuum in Terahertz Windows Q. Ma, R. H. Tipping ............................. 21 1.9 A Semi-Empirical Adjustment of The Vibrational Dependence of the Po- larizability of Ozone for Use in Line Shift Calculations C. Szembek, B. K. Antony, R. R. Gamache . 22 1.10 Spectroscopic Study of Line Mixing E®ects in the º2 +º3 Band of Methane A. Vasudevan Unn, H. Heung, A. Predoi-Cross, L. R. Brown, D. Chris Benner, V. Malathy Devi ................................ 23 1.11 Measurements and Theoretical Calculations of Self- and Air-Broadening and Shift Coe±cients in the º2 Band of CH3D A. Predoi-Cross, K. Hambrook, M. Brawley-Tremblay, S. Brawley-Tremblay, C. Povey, J.-P. Bouanich, L. R. Brown, V. Malathy Devi, D. Chris Benner, Mary Ann H. Smith .............................. 24 1.12 High Accuracy Laboratory Spectroscopy for Atmospheric Applications D. Chris Benner, V. Malathy Devi, C. E. Miller, L. R. Brown, and R. Toth . 25 ii 1.13 Observations of SO2 Spectra with a Quantum Cascade Laser Spectrom- eter around 1090 and 1160 cm¡1: Comparison with HITRAN Database and Updated Calculations V. Z¶eninari,L. Joly, B. Grouiez, B. Parvitte, A. Barbe . 27 1.14 Recent Progress in the Knowledge of C2H2 Spectroscopic Parameters in the IR D. Jacquemart, N. Lacome, J.-Y. Mandin, V. Dana, F. Gueye, O.M. Lyulin, V.I. Perevalov, L. R¶egalia-Jarlot,X. Thomas, P. Von Der Heyden . 28 1.15 Absolute Line Intensities in the º2 Band, and Ground-state Electric Dipole Moment, of HOBr J. Vander Auwera, J. Kle®mann, G. Pawelke, H. BÄurger,I. Merke, T. Giesen, O. Baum, J.-M. Flaud ............................. 29 1.16 Infrared Absorption Cross Section of CFC-113: Calculations and Mea- surements K. Le Bris, S. Melo, K. Strong ......................... 31 1.17 Developing a Phenomenological Model of Infrared Emissions from Deto- nation Fireballs for Explosives Identi¯cation K. C. Gross, G. P. Perram, R. F. Tuttle .................... 32 1.18 Rapid And Accurate Calculation of the Voigt Function D. Chris Benner, K. L. Letchworth ....................... 33 DAY 2, Tuesday 27 June SESSION 3: Remote Sensing 34 What about the Spectral Parameters when Performing Synergistic Atmo- spheric Measurements? J.-M. Flaud, B. Picquet-Varrault, A. Gratien, J. Orphal, J.-F. Doussin . 35 Linelist Needs for the Atmospheric Chemistry Experiment C. D. Boone, P. F. Bernath .......................... 36 CO2 Spectroscopy Evaluation Using FTS Spectra B. Sen, L. R. Brown, C.E. Miller, G. C. Toon, R.A. Toth, R. A. Washenfelder, P. O. Wennberg ................................ 37 Infrared Laboratory Spectroscopy of CH4 and CH3D for Atmospheric Re- mote Sensing Linda R. Brown ................................ 38 Spectroscopic Parameter Requirements for Remote Sensing of Terrestrial Planets Mary Ann H. Smith .............................. 39 iii SESSION 4: Laboratory Spectroscopy 40 THz Studies of Water Vapor V. B. Podobedov, G. T. Fraser, D. F. Plusquellic . 41 HDO and D2O Long Path Spectroscopy: On-Going Work of the Brussels- Reims Team L. Daumont, A. Jenouvrier, M. Carleer, S.