english  Spectroscopy & Molecular Properties of Ozone
 Home   Molecule   Energy Levels   Transitions   Spectra Simulation   Experiment   Cross-Sections   Direct problem   Auxiliary data   References 
 
 Help 
 
SECTION CONTENTS
O: Original
H: High resolution spectra
L: Low resolution spectra
T: Theory
E: Electronic structure
P: Potential
C: Chemistry
A: Atmosphere
D: Databases

Theoretical background / ro-vibrational models

  1. D.M. Dennison, The Rotation of Molecules // Phys. Rev., 28, 318-333 (1926) (doi:10.1103/PhysRev.28.318)
  2. J.H. Van Vleck, On s-Type Doubling and Electron Spin in the Spectra of Diatomic Molecules // Phys. Rev., 33, 467-506 (1929) (doi:10.1103/PhysRev.33.467)
  3. S.C. Wang, On the Asymmetrical Top in Quantum Mechanics // Phys. Rev., 34, 243-252 (1929) (doi:10.1103/PhysRev.34.243)
  4. C. Eckart, Some Studies Concerning Rotating Axes and Polyatomic Molecules // Phys. Rev., 47, 552-558 (1935) (doi:10.1103/PhysRev.47.552)
  5. B.T. Darling, D.M. Dennison, The Water Vapor Molecule // Phys. Rev., 57, 128-139 (1940) (doi:10.1103/PhysRev.57.128)
  6. G.W. King, R.M. Hainer, P.C. Cross, The Asymmetric Rotor. I. Calculation and Symmetry Classification of Energy Levels // J. Chem. Phys., 11, 27-42 (1943) (doi:10.1063/1.1723778)
  7. P.C. Cross, R.M. Hainer, G.W. King, The Asymmetric Rotor. II. Calculation of Dipole Intensities and Line Classification // J. Chem. Phys., 12, 210-243 (1944) (doi:10.1063/1.1723935)
  8. B.L. Crawford, H.L. Dinsmore , Vibrational Intensities. I. Theory of Diatomic Infra‐Red Bands // J. Chem. Phys., 18, 983-987 (1950) (doi:10.1063/1.1747823)
  9. H.H. Nielsen, The Vibration-Rotation Energies of Molecules // Rev. Mod. Phys., 23, 90-136 (1951) (doi:10.1103/RevModPhys.23.90)
  10. B. Crawford, Vibrational Intensities. II. The Use of Isotopes // J. Chem. Phys., 20, 977-981 (1952) (doi:10.1063/1.1700660)
  11. B.T. Darling, J.A. Weiss, Theory of the Ozone Molecule // J. Chem. Phys., 20, 747-748 (1952) (doi:10.1063/1.1700537)
  12. D. Kivelson, E.B. Wilson Jr., Theory of Centrifugal Distortion Constants of Polyatomic Rotor Molecules // J. Chem. Phys., 21, 1229-1236 (1953) (doi:10.1063/1.1699170)
  13. J.H. Meal, S.R. Polo, Vibration-Rotation Interaction in Polyatomic Molecules. II. The determination of Coriolis Coupling Constants // J. Chem. Phys., 24, 1126-1133 (1956) (doi:10.1063/1.1742729)
  14. M. Goldsmith, G. Amat, H.H. Nielsen, Higher Order Rotation-Vibration Energies of Polyatomic Molecules. I // J. Chem. Phys., 24, 1178-1182 (1956) (doi:10.1063/1.1742736)
  15. J.H. Meal, S.R. Polo, Vibration-Rotation Interaction in Polyatomic Molecules. I. The Zeta Matrices // J. Chem. Phys., 24, 1119-1125 (1956) (doi:10.1063/1.1742728)
  16. G. Amat, H.H. Nielsen, Higher Order Rotation-Vibration Energies of Polyatomic Molecules. IV // J. Chem. Phys., 29, 665-672 (1958) (doi:10.1063/1.1744557)
  17. L. Henry, G. Amat, Sur les Coefficients d'Interaction Entre la Vibration et la Rotation dans les Molecules Polyatomiques. II. // Cahiers de Physique, 118, 230-256 (1960)
  18. E.B. Wilson, J.C. Decius, P.C. Cross, Molecular Vibrations, The Theory of Infrared and Raman Vibrational Spectra // Mc.Graw-Hill, New York-London-Toronto (1960) (ISBN 10:048663941X)
  19. T.C. James, Wave Functions and Intensity Calculations for a Rotating Anharmonic Oscillator // J. Chem. Phys., 35, 767-773 (1961) (doi:10.1063/1.1701214)
  20. I.M. Mills, Vibrational Perturbation Theory // J. Mol. Spectrosc., 5, 334-340 (1961) (doi:10.1016/0022-2852(61)90098-4)
  21. R.H. Schwendeman, The Matrix Elements of the Direction Cosines in the Wang Symmetric Rotator Basis // J. Mol. Spectrosc., 7, 280-286 (1961) (doi:10.1016/0022-2852(61)90361-7)
  22. D.R. Herschbach, V.W. Laurie, Influence of Vibrations on Molecular Structure Determinations. I. General Formulation of Vibration-Rotation Interactions // J. Chem. Phys., 37, 1668-1686 (1962) (doi:10.1063/1.1733357)
  23. K. Kuchitsu, Y. Morino, Estimation of Anharmonic Potential Constants. II. Bent XY2 Molecules // Bull. Chem. Soc. Japan, 38, 814-824 (1965) (doi:10.1246/bcsj.38.814)
  24. K. Kuchitsu, Y. Morino, Estimation of Anharmonic Potential Constants. I. Linear XY2 Molecules // Bull. Chem. Soc. Japan, 38, 805-813 (1965) (doi:10.1246/bcsj.38.805)
  25. I.M. Mills, Coriolis Interactions, Intensity Perturbations and Potential Functions in Polyatomic Molecules // Pure Appl. Chem., 11, 325-344 (1965) (doi:10.1351/pac196511030325)
  26. J.K.G. Watson, Centrifugal Corrections for Asymmetric-Top Molecules // J. Chem. Phys., 45, 1360-1361 (1966) (doi:10.1063/1.1727763)
  27. G. Herzberg, Electronic Spectra of Polyatomic Molecules // Van Nostrand, New York (1966)
  28. J.E. Wollrab, Rotational Spectra and Molecular Structure // Academic Press, New York (1967)
  29. J.K.G. Watson, Determination of Centrifugal Distortion Coefficients of Asymmetric Top Molecules // J. Chem. Phys., 46, 1935-1949 (1967) (doi:10.1063/1.1840957)
  30. J. Pliva, V. Spirko, D. Papousek, Anharmonic Potential Functions of Polyatomic Molecules. Part VII. Iterational Calculation of Anharmonic Corrections to Fundamental Frequencies // J. Mol. Spectrosc., 23, 331-342 (1967) (doi:10.1016/S0022-2852(67)80022-5)
  31. J.K.G. Watson, Determination of Centrifugal-Distortion Coefficients of Asymmetric-Top Molecules. III. Sextic Coefficients // J. Chem. Phys., 48, 4517-4524 (1968) (doi:10.1063/1.1668020)
  32. J.K.G. Watson, Determination of Centrifugal-Distortion Coefficients of Asymmetric-Top Molecules. II. Drezler, Dendl, Rudolph's Results // J. Chem. Phys., 48, 181-185 (1968) (doi:10.1063/1.1667898)
  33. D.E. Freeman, Determination of Molecular Vibrational Force Constants from Kinematically Defined Normal Coordinates // J. Mol. Spectrosc., 27, 27-43 (1968) (doi:10.1016/0022-2852(68)90017-9)
  34. J.K.G. Watson, Simplification of the Molecular Vibration-Rotation Hamiltonian // Mol. Phys., 15, 479-490 (1968) (doi:10.1080/00268976800101381 )
  35. D.E. Freeman, On a New Method for the Calculation of Dipole Moment Derivatives from Infrared Intensities // Chem. Phys. Lett., 4, 165-166 (1969) (doi:10.1016/0009-2614(69)80087-4)
  36. K. Machida, J. Overend, Anharmonic Strech-Strech Interaction Force Constants of Triatomic Molecules // J. Chem. Phys., 50, 4429-4436 (1969) (doi:10.1063/1.1670915)
  37. J. Braslawsky, Y. Ben-Aryeh, First-Order Intensity Perturbations for the Vibration-Rotation Lines of Asymmetric Rotor: Theory and Application // J. Chem. Phys., 51, 2233-2241 (1969) (doi:10.1063/1.1672321)
  38. I.M. Mills, J.K.G. Watson, W.L. Smith, Rotational Spectra Induced by Vibrations // Mol. Phys., 16, 329-344 (1969) (doi:10.1080/00268976900100391)
  39. A.Ya. Tsaune, N.T. Storchai, L.V. Belyavskaya, V.P. Morozov, The Relationship Between Nonlinear and Linear Internal Coordinates in the Theory of Molecular Vibrations // Opt. Spectrosc., 26, 502-504 (1969)
  40. T. Tanaka, Y. Morino, Coriolis Interaction and Anharmonic Potential Function of Ozone from the Microwave Spectra in the Excited Vibrational States // J. Mol. Spectrosc., 33, 538-551 (1970) (doi:10.1016/0022-2852(70)90148-7)
  41. A.P. Aleksandrov, M.R. Aliev, V.T. Aleksanyan, Isotopic Relationships Between Centrifugal Distortion Constants of Polyatomic Molecules // Opt. Spectrosc., 29, 568-571 (1970)
  42. G. Amat, H.H. Nielsen, G. Tarrago, Rotation-Vibration of Polyatomic Molecules // Dekker, New York (1971)
  43. S. Flugge, Practical Quantum Mechanics // Springer-Verlag, Berlin (1971)
  44. A.R. Hoy, I.M. Mills, G. Strey, Anharmonic Force Constant Calculations // Mol. Phys., 24, 1265-1290 (1972) (doi:10.1080/00268977200102361)
  45. I.M. Mills, in "A Special Periodic Report, Theoretical Chemistry, Vol.I" // Dixon R.N., Ed; Chemical Society, London (1974)
  46. A. Barbe, C. Secroun, P. Jouve, Infrared Spectra of 16O3 and 18O3: Darling and Dennison Resonance and Anharmonic Potential Function of Ozone // J. Mol. Spectrosc., 49, 171-182 (1974) (doi:10.1016/0022-2852(74)90267-7)
  47. R. Wallace, A Theory of Nuclear Motion in Polyatomic Molecules Based upon Morse Oscillator // Chem. Phys., 11, 189-199 (1975) (doi:10.1016/0301-0104(75)80051-6)
  48. M. Aida, A Theoretical Examination of Absorption in the 9-6 Micron Ozone Band // J. Quant. Spectrosc. Radiat. Transfer, 15, 389-403 (1975) (doi:10.1016/0022-4073(75)90057-6)
  49. C. Camy-Peyret, J.-M. Flaud, These de Doctorat en sciences // Universite Pierre et Marie Curie, Paris (1975)
  50. J. Overend, Intensities of Vibrational Difference Bands // J. Chem. Phys., 64, 2878-2879 (1976) (doi:10.1063/1.432589)
  51. Vl.G. Tyuterev, Contact Transformation and dynamic variables, in "Molecular High-Resolution Spectroscopy" // Nauka, Novosibirsk, 93-115 (1976) (in Russian)
  52. W.C. Elmer, B.J. Krohn, Nuclear Corrections to Molecular Properties // J. Chem. Phys., 67, 1360-1374 (1977) (doi:10.1063/1.435035)
  53. M.J.C. Depannemaecker, B. Duterage, M.J. Bellet, Systematic Calculations of Rotational Spectra of Normal and Substituted ( 18O in Place of 16O) Ozone Molecules // J. Quant. Spectrosc. Radiat. Transfer, 17, 519-530 (1977) (doi:10.1016/0022-4073(77)90099-1)
  54. Yu.S. Efremov, On the Calculation of Matrix Elements with Eigenfunctions of Morse Oscillators // Opt. Spectrosc., 43, 1174-1176 (1977)
  55. A. Niroomand, P.M. Parker, Recalculation of Sextic Centrifugal Distortion Constants of Ozone // J. Mol. Spectrosc., 75, 177-180 (1979) (doi:10.1016/0022-2852(79)90114-0)
  56. Vl.G. Tyuterev, V.I. Perevalov, Generalized Contact Transformations for Quasi-Degenerate Levels // Chem. Phys. Lett., 74, 494-502 (1980) (doi:10.1016/0009-2614(80)85260-2)
  57. C. Jaffe, P. Brumer, Local and Normal Modes: A Classical Perspective // J. Chem. Phys., 73, 5646-5658 (1980) (doi:10.1063/1.440041)
  58. M.S. Child, L. Halonen, Local and Normal Vibrational States: A Harmonically Coupled Anharmonic-Oscillator Model // Faraday Discuss. Chem. Soc., 71, 273-285 (1981) (doi:10.1039/DC9817100273)
  59. A.J.C. Varandas, J.N. Murrell, Dynamics of the 18O+16O2 (v=0) Exchange Reaction on a New Potential Energy Surface for Ground-State Ozone // Chem. Phys. Lett., 88, 1-6 (1982) (doi:10.1016/0009-2614(82)80058-4)
  60. D. Papousek, M.R. Aliev, Molecular Vibration-Rotation Spectra // Elsevier (1982)
  61. V.I. Perevalov, Vl.G. Tyuterev, Reduction of the Centrifugal Distortion Hamiltonian of Asymmetric Top Molecules in the Case of Accidental Resonances // J. Mol. Spectrosc., 96, 56-76 (1982) (doi:10.1016/0022-2852(82)90214-4)
  62. V.I. Perevalov, Vl.G. Tyuterev, Effective Centrifugal Distortion Hamiltonian with Empirically Determinable Parameters in the Case of Coriolis Resonances for Asymmetric Top Molecules // Opt. Spectrosc., 52, 644-650 (1982)
  63. V.I. Perevalov, Vl.G. Tyuterev, A Model with Empirically Determinable Parameters For Simultaneous Treatment of Two Interacting Vibrational States. Anharmonic Resonances in Asymmetric Top Molecules // Rus. Phys. J., 25, 179-182 (1982) (doi:10.1007/BF00897179)
  64. K.K. Lehmann, On the Relation of Child and Lawton's Harmonically Coupled Anharmonic-Oscillator Model and Darling-Dennison Coupling // J. Chem. Phys., 79, 1098 (1983) (doi:10.1063/1.445849)
  65. Yu.S. Makushkin, Vl.G. Tyuterev, Perturbation Methods and Effective Hamiltonians in Molecular Spectroscopy // Nauka, Novosibirsk (1984)
  66. J.N. Murrell, S. Carter, S.C. Farantos, P. Huxley, A.J.C. Varandas, Molecular Potential Energy Function // Wiley, Chichester (1984)
  67. I.M. Mills, Molecular Spectroscopy: Modern Research // Academic Press, New York (1985)
  68. C. Camy-Peyret, J.-M. Flaud, Vibration-Rotation Dipole Moment Operator for Asymmetric Rotors, in "Molecular Spectroscopy: Modern Research, Vol.III" // Academic Press, Orlando, 69-110 (1985)
  69. M.R. Aliev, J.K.G. Watson, Higher-Order Effects in the Vibration-Rotation Spectra of Semirigid Molecules, in "Molecular Spectroscopy: Modern Research, Vol.III" // Academic Press: San Diego, CA, 1-67 (1985)
  70. I.M. Pavlichenkov, B.I. Zhilinskii, Rotation of Molecules Around Specific Axes Reorientation under Rotational Excitation // Chem. Phys., 100, 339-354 (1985) (doi:10.1016/0301-0104(85)87060-9)
  71. E. Willemot, Vibration-Rotation Hamiltonian for Asymmetric CS Molecules Adapted to Very Strong Coriolis Resonance. Application to Microwave Reinvestigations of the v7 and v9 States of H12COOH and D12COOH // J. Mol. Spectrosc., 120, 246-275 (1986) (doi:10.1016/0022-2852(86)90002-0)
  72. S. Carter, N.C. Handy, A Theoretical Determination of the Rovibrational Energy Levels of the Water Molecule // J. Chem. Phys., 87, 4294-4301 (1987) (doi:10.1063/1.452887)
  73. T.J. Lee, W.D. Allen, H.F. Schaefer III, The Analytic Evaluation of Energy First Derivatives for Two-Configuration Self-Consistent-Field Configuration Interaction (TCSCF-CI) Wave Functions. Application to Ozone and Ethylene // J. Chem. Phys., 87, 7062-7075 (1987) (doi:10.1063/1.453352)
  74. J.I. Steinfeld, S.M. Adler-Golden, J.W. Gallagher, Critical Survey on the Spectroscopy and Kinetics of Ozone in the Mesosphere and Thermosphere // J. Phys. Chem. Ref. Data, 16, 911-952 (1987) (doi:10.1063/1.555796)
  75. P. Jensen, A New Morse Oscillator-Rigid Bender Internal Dynamics (MORBID) Hamiltonian for Triatomic Molecules // J. Mol. Spectrosc., 128, 478-501 (1988) (doi:10.1016/0022-2852(88)90164-6)
  76. L. Xiao, M.E. Kellman, Unified Semiclassical Dynamics for Molecular Resonance Spectra // J. Chem. Phys., 90, 6086-6098 (1989) (doi:10.1063/1.456374)
  77. A. Bastida, J. Zuniga, A. Requena, Improved Analytic Potential Models for Bent AB2 Molecules // J. Mol. Spectrosc., 136, 185-196 (1989) (doi:10.1016/0022-2852(89)90231-2)
  78. P. Jensen, The Potential Energy Surface for the Electronic Ground State of the Water Molecule Determined from Experimental Data Using a Variational Approach // J. Mol. Spectrosc., 133, 438-460 (1989) (doi:10.1016/0022-2852(89)90203-8)
  79. J. Makarevitch, J. Pyka, Centrifugal Stabilization and Destabilization of Molecular Geometry and Clustering of Rovibrational Energy Levels in the H2O // Mol. Phys., 68, 107-127 (1989) (doi:10.1080/00268978900102001)
  80. J.-M. Flaud, C. Camy-Peyret, C.P. Rinsland, M.A.H. Smith, V. Malathy Devi, Atlas of Ozone Spectral Parameters from Microwave to Medium Infrared // Academic Press, Boston, 600p. (1990) (ISBN: 0122598903 / 0-12-259890-3)
  81. K.K. Lehmann, The Interaction of Rotation and Local Mode Tunneling in the Overtone Spectra of Symmetrical Hydrides // J. Chem. Phys., 95, 2361-2370 (1991) (doi:10.1063/1.460942)
  82. D.W. Schwenke, On the Computation of Ro-Vibrational Energy Levels of Triatomic Molecules // Comput. Phys. Commun., 70, 1-14 (1992) (doi:10.1016/0010-4655(92)90086-E)
  83. S.E. Choi, J.C. Light, Highly Excited Vibrational Eigenstates of Nonlinear Triatomic Molecules. Application to H2O // J. Chem. Phys., 97, 7031-7054 (1992) (doi:10.1063/1.463530)
  84. J. Tennyson, S. Miller, J.R. Henderson, in "Methods in Computational Chemistry", Vol.4, ed. by S. Wilson // Plenum, New York (1992)
  85. J.R. Henderson, C.R. Le Sueur, J. Tennyson, DVR3D: Programs for Fully Pointwise Calculation of Vibrational Spectra // Comput. Phys. Commun., 75, 379-395 (1993) (doi:10.1016/0010-4655(93)90050-M)
  86. M.J. Bramley, T. Carrington Jr., A General Discrete Variable Method to Calculate Vibrational Energy Levels of Three- and Four-Atom Molecules // J. Chem. Phys., 99, 8519-8541 (1993) (doi:10.1063/1.465576)
  87. P. Jensen, S.A. Tashkun, Vl.G. Tyuterev, A Refined Potential Energy Surface for the Electronic Ground State of the Water Molecule // J. Mol. Spectrosc., 168, 271-289 (1994) (doi:10.1006/jmsp.1994.1277)
  88. S.A. Tashkun, Vl.G. Tyuterev, GIP: A Program for Experimental Data Reduction in Molecular Spectroscopy // SPIE Proceeding Series, 2205, 188-191 (1994) (doi:10.1117/12.166203)
  89. S.I. Ivanov, V.Ya. Panchenko, Infrared and Microwave Spectroscopy of Ozone: Historical Aspects // Usp. Fiz. Nauk, 164, 677-695 (1994) (doi:10.1070/PU1994v037n07ABEH000034)
  90. D.W. Schwenke, Correction: Variational Calculations of Rovibrational Energy Levels and Transition Intensities for Tetratomic Molecules // J. Phys. Chem., 100, 18884 (1996) (10.1021/jp9629147)
  91. D.W. Schwenke, Variational Calculations of Rovibratonal Energy Levels and Transition Intensities for Tetratomic Molecules // J. Phys. Chem., 100, 2867-2884 (1996) (doi:10.1021/jp9525447)
  92. G.I. Gellene, An Explanation for Symmetry-Induced Isotopic Fraction in Ozone // Science, 274, 1344-1346 (1996) (doi:10.1126/science.274.5291.1344)
  93. H. Partridge, D.W. Schwenke, The Determination of an Accurate Isotope Dependent Potential Energy Surface for Water from Extensive ab initio Calculations and Experimental Data // J. Chem. Phys., 106, 4618-4639 (1997) (doi:10.1063/1.473987)
  94. A. Barbe, S.N. Mikhailenko, J.J. Plateaux, First Observation of the v2=3 State of Ozone: the (131) State Through Analysis of Cold and Hot Bands. Study of v2 Behavior // J. Mol. Spectrosc., 184, 448-453 (1997) (doi:10.1006/jmsp.1997.7350)
  95. A. Barbe, J.J. Plateaux, S.N. Mikhailenko, Vl.G. Tyuterev, Infrared Spectrum of Ozone in the 4600 and 5300cm-1 Regions: High Order Accidental Resonances Through the Analysis of v1+2v2+3v3-v2 , v1+2v2+3v3 , and 4v1+v3 Bands // J. Mol. Spectrosc., 185, 408-416 (1997) (doi:10.1006/jmsp.1997.7374)
  96. F. Perez-Bernal, J.M. Arais, A. Frank, R. Lemus, R. Bijker, Symmetry-Adapted Algebraic Description of Stretching and Bending Vibrations of Ozone // J. Mol. Spectrosc., 184, 1-11 (1997) (doi:10.1006/jmsp.1997.7296)
  97. V.I. Starikov, Vl.G. Tyuterev, Intramolecular Ro-Vibrational Interactions and Theoretical Methods in the Spectroscopy of Nonrigid Molecules // Tomsk: SB RAS, 230p. (1997) (in Russian)
  98. A. Barbe, J.J. Plateaux, Vl.G. Tyuterev, S.N. Mikhailenko, Analysis of High Resolution Measurements of the 2v1+3v3 Bands of Ozone: Coriolis Interaction with the v1+3v2+2v3 Band // J. Quant. Spectrosc. Radiat. Transfer, 59, 185-194 (1998) (doi:10.1016/S0022-4073(97)00117-9)
  99. A. Barbe, A. Chichery, Vl.G. Tyuterev, J.J. Plateaux, Analysis of High Resolution Measurements of the v1+5v3 Band of Ozone: Coriolis Interactions with the 6v3 and 3v1+v2+2v3 Bands // Mol. Phys., 94, 751-757 (1998) (doi: 10.1080/002689798167593)
  100. P.R. Bunker, P. Jensen, Molecular Symmetry and Spectroscopy // NRC Research Press, Ottawa (1998) (ISBN: 0660175193)
  101. A. Barbe, A. Chichery, Vl.G. Tyuterev, S.A. Tashkun, S.N. Mikhailenko, The 2v2 and 3v2-v2 Bands of Ozone // Spectrochimica Acta, 54A, 1935-1945 (1998) (doi:10.1016/S1386-1425(98)00156-5)
  102. J.-M. Flaud, R. Bacis, The Ozone Molecule: Infrared and Microwave Spectroscopy // Spectrochimica Acta, 54A, 3-16 (1998) (doi:10.1016/S1386-1425(97)00214-X)
  103. R. Bacis, A.J. Bouvier, J.-M. Flaud, The Ozone Molecule: Electronic Spectroscopy // Spectrochimica Acta, 54A, 17-34 (1998) (doi:10.1016/S1386-1425(97)00259-X)
  104. S.N. Mikhailenko, A. Barbe, Vl.G. Tyuterev, A. Chichery, High Resolution IR Spectra of the Ozone Molecule // Atmos. Ocean. Opt., 12, 771-785 (1999)
  105. S.N. Mikhailenko, A. Barbe, J.J. Plateaux, Vl.G. Tyuterev, New Analysis of 2v1+v2 , v1+v2+v3 , and v2+2v3 Bands of Ozone in the 2600-2900cm-1 Region // J. Mol. Spectrosc., 196, 93-101 (1999) (doi:10.1006/jmsp.1999.7851)
  106. Vl.G. Tyuterev, S.A. Tashkun, P. Jensen, A. Barbe, T. Cours, Determination of the Effective Ground State Potential Energy Function of Ozone from High-Resolution Infrared Spectra // J. Mol. Spectrosc., 198, 57-76 (1999) (doi:10.1006/jmsp.1999.7928)
  107. R.D. Vocke Jr., Atomic Weights of the Elements. 1997 // Pure Appl. Chem., 71, 1593-1607 (1999) (doi:10.1351/pac199971081593)
  108. R.D. Vocke, Jr., Errata: Atomic weights of the elements: (Technical Report) // Pure Appl. Chem., 71, 1808 (1999) (doi:10.1351/pac199971091808)
  109. Vl.G. Tyuterev, S.A. Tashkun, D.W. Schwenke, P. Jensen, T. Cours, A. Barbe, M. Jacon, Variational EKE-Calculations of Rovibrational Energies of the Ozone Molecule from an Empirical Potential Function // Chem. Phys. Lett., 316, 271-279 (2000) (doi:10.1016/S0009-2614(99)01228-2)
  110. O.N. Sulakshina, Yu. Borkov, Vl.G. Tyuterev, A. Barbe, Third-Order Derivatives of the Dipole Moment Function for the Ozone Molecule // J. Chem. Phys., 113, 10572-10582 (2000) (doi:10.1063/1.1290614)
  111. A. Chichery, A. Barbe, Vl.G. Tyuterev, O.N. Sulakshina, Yu. Borkov, Intensities of the Difference Bands v1+v3-v2 and 2v3-v2 of Ozone. Comparison with Theoretical Predictions // J. Mol. Structure, 517-518, 165-170 (2000) (doi:10.1016/S0022-2860(99)00247-1)
  112. K. Sarka, J. Demaison, Perturbation Theory, Effective Hamiltonians and Force Constants, in "Computational Molecular Spectroscopy" // J. Wiley & Sons, Chichester (2000) (ISBN 0-471-48998-0)
  113. P. Jensen, P. Bunker, Computational Molecular Spectroscopy // J. Wiley & Sons, Chichester (2000) (ISBN 0-471-48998-0)
  114. P.J. Mohr, B.N. Taylor, CODATA Recommended Values of the Fundamental Physical Constants: 1998 // Rev. Mod. Phys., 72, 351-495 (2000) (doi:10.1103/RevModPhys.72.351)
  115. Vl.G. Tyuterev, T. Cours, S.A. Tashkun, A. Barbe et P. Jensen, The Potential Function of the Ozone Molecule: Global Calculations of the Rovibrational States and the Dissociation Behavior // SPIE Proceeding Series, 4063, 142-151 (2000) (doi:10.1117/12.375367)
  116. T. Cours, These de Doctorat // Universite de Reims (2000)
  117. Vl.G. Tyuterev, V.I. Perevalov, V.I. Starikov, Method of Effective Operators in Theory of High-Resolution Molecular Spectra, in “Modern Problems of Optics and Spectroscopy” // in “Modern Problems of Optics and Spectroscopy”, TGU, Tomsk (2001)
  118. R.R. Gamache, Calculated Partition Functions for Ozone Isotopic Species // Private Communication (2001) (private communication)
  119. S. Mikhailenko, A. Barbe, Vl.G. Tyuterev, Extended Analysis of Line Positions and Intensities of Ozone Bands in the 2900-3400 cm-1 Region // J. Mol. Spectrosc., 215, 29-41 (2002) (doi:10.1006/jmsp.2002.8597)
  120. Vl.G. Tyuterev, Recent Advances in Global Variational and Effective Calculations of the Line Positions and Intensities for Triatomic Molecules: Some Features of a New Generation of Spectroscopic Databanks // Atmos. Ocean. Opt., 16, 220-231 (2003)
  121. M.R.De Backer-Barilly, A.Barbe, Vl.G.Tyuterev, First Observation of the 3v1+2v3-v3 Band of 16O3: Problem of Consistency Between Cold and Hot Band Intensities // Mol. Phys., 102, 1707-1716 (2004) (doi:10.1080/00268970412331287061)
  122. Vl.G. Tyuterev, S.A. Tashkun, D.W. Schwenke, A. Barbe, Variational Calculations of High-J Rovibrational States of the Ozone Molecule from Empirically Determined Isotopically Invariant Potential Energy Surface // SPIE Proceedings Series, 5311, 176-184 (2004) (doi:10.1117/12.545644)
  123. Ch. Wenger, M. Rotger, V. Boudon, C2V Top Data System (C2V TDS) Software for Infrared Spectrum Simulation of XY2Z2 Asymmetric Molecules: Some Improvements to the TDS Packages // J. Quant. Spectrosc. Radiat. Transfer, 93, 429-446 (2005)
  124. Ch. Wenger, W. Raballand, M. Rotger, V. Boudon, D2h Top Data System (D2h TDS) Software for Spectrum Simulation of X2Y4 Asymmetric Molecules // J. Quant. Spectrosc. Radiat. Transfer, 95, 521-538 (2005)
  125. I.N. Kozin, D.A. Sadovskii, B.I. Zhilinskii, Assigning Vibrational Polyads Using Relative Equilibria: Application to Ozone // Spectrochimica Acta, 61A, 2867-2885 (2005) (doi:10.1016/j.saa.2004.10.039)
  126. V.I. Starikov, Analytical Representation for the Coefficients of the Pressure Broadening of the Ozone Absorption lines by Ozxygen, Air, and Self-Broadening // Atmos. Ocean. Opt., 19, 636-640 (2006)
  127. J. Zuniga, J.A.G. Picon, A. Bastida, A. Requena, Optimal Internal Coordinates, Vibrational Spectrum, and Effective Hamiltonian for Ozone // J. Chem. Phys., 126, 244305 (2007) (doi:10.1063/1.2743441)
  128. F. Rohart, G. Wlodarczak, J.-M. Colmont, G. Cazzoli, L. Dore, C. Puzzarini, Galatry Versus Speed-Dependent Voigt Profiles for Millimeter Lines of O3 in Collision With N2 and O2 // J. Mol. Spectrosc., 251, 282-292 (2008) (doi:10.1016/j.jms.2008.03.005)
  129. E.N. Starikova, A. Barbe, M.-R. De Backer-Barilly, Vl.G. Tyuterev, S.A. Tashkun, S. Kassi, A. Campargue, Isotopic Shifts in Vibration Levels of Ozone Due to Homogeneous Substitutions: Band Centres of 18O3 Derived from Analysis of CW-CRDS Spectra in the 5900-7000 cm-1 Range // Chem. Phys. Lett., 470, 28-34 (2009) (doi:10.1016/j.cplett.2008.12.098)
  130. J. Buldyreva, N. Lavrentieva, Nitrogen and Oxygen Broadening of Ozone Infrared Lines in the 5µm Region: Theoretical Predictions by Semiclassical and Semiempirical Methods // Mol. Phys., 107, 1527-1536 (2009) (doi:10.1080/00268970902953612)
  131. N. Lavrentieva, A. Osipova, J. Buldyreva, Calculations of Ozone Line Shifting Induced by N2 and O2 Pressure // Mol. Phys., 107, 2045-2051 (2009) (doi:10.1080/00268970903136639)
  132. M. Pabst, A. Kohn , J. Gauss, J.F. Stanton, A Worrisome Failure of the CC2 Coupled-Cluster Method When Applied to Ozone // Chem. Phys. Lett., 495, 135-140 (2010) (doi:10.1016/j.cplett.2010.06.023)
  133. A. El Hilali, Ch. Wenger, V. Boudon, M. Loete, C3V Top Data System (C3VTDS) Software for Spectrum Simulation of XY3Z Symmetric-Top Molecules Using the O(3) => CooV => C3V Group Chain // J. Quant. Spectrosc. Radiat. Transfer, 111, 1305-1315 (2010)
  134. J. Lamouroux, H. Tran, A.L. Laraia, R.R. Gamache, L.S. Rothman, I.E. Gordon, J.-M. Hartmann, Updated Database Plus Software for Line-Mixing in CO2 Infrared Spectra and Their Test Using Laboratory Spectra in the 1.5-2.3 mm Region // J. Quant. Spectrosc. Radiat. Transfer, 111, 2321-2331 (2010)
  135. V.I. Starikov, Calculation and Analytical Representation of Self-Pressure and Air Pressure Broadening Coefficients of Ozone Spectral Lines // Opt. Spectrosc., 88, 340-350 (2011) (doi:10.1134/S0030400X11030222)
  136. Vl.G. Tyuterev, R.V. Kochanov, S.A. Tashkun, Analytical Representation for the Ozone Electronic Ground State Potential Function in the Spectroscopically Accessible Range and Extended Vibration Predictions // Proceedings of XVII International Symposium HighRus-2012, J06 (2011)
  137. G. Maroulis, A Note on the Electric Quadrupole and Higher Electric Moments of Ozone (O3) // Chem. Phys. Lett., 525-526, 49–53 (2012) (doi:10.1016/j.cplett.2012.01.010)
  138. M. Lepers, B. Bussery-Honvault, O. Dulieu, Long-Range Interactions in the Ozone Molecule: Spectroscopic and Dynamical Points of View // J. Chem. Phys., 137, 234305 (2012) (doi:10.1063/1.4770054)
  139. M.V. Ivanov, D. Babikov, Efficient Quantum-Classical Method for Computing Thermal Rate Constant of Recombination: Application to Ozone Formation // J. Chem. Phys., 136, 184304 (2012) (doi:10.1063/1.4711760)
  140. A. Barbe, M.-R. De Backer, E. Starikova, S.A. Tashkun, X. Thomas, Vl.G. Tyuterev, FTS High Resolution Spectra of 16O3 in 3500 and 5500 cm−1 Regions. First Example of New Theoretical Modelling for a Polyad of Strongly Coupled States // J. Quant. Spectrosc. Radiat. Transfer, 113, 829-839 (2012) (doi:10.1016/j.jqsrt.2012.02.034)
  141. Vl.G. Tyuterev, R.V. Kochanov, S.A. Tashkun, F. Holka, P.G. Szalay, New Analytical Model for the Ozone Electronic Ground State Potential Surface and Accurate ab initio Vibrational Predictions at High Energy Range // J. Chem. Phys., 139, 134307 (2013) (doi:10.1063/1.4821638)
  142. D. Mondelain, A. Campargue, S. Kassi, A. Barbe, E. Starikova, M.-R. De Backer, Vl.G. Tyuterev, The CW-CRDS spectra of the 16O/18O isotopologues of ozone between 5930 and 6340 cm-1 — Part 1: 16O16O18O // J. Quant. Spectrosc. Radiat. Transfer, 116, 49-66 (2013) (doi:10.1016/j.jqsrt.2012.10.023)
  143. Vl.G. Tyuterev, R. Kochanov, A. Campargue, S. Kassi, D. Mondelain, A. Barbe, E. Starikova, M.R. De Backer, P.G. Szalay, S. Tashkun, Does the “Reef Structure” at the Ozone Transition State Towards the Dissociation Exist? New Insight from Calculations and Ultrasensitive Spectroscopy Experiments // Phys. Rev. Lett., 113, 143002 (2014) (doi:10.1103/PhysRevLett.113.143002)
  144. S. Ndengué, R. Dawes, X.-G. Wang, T. Carrington Jr., Z. Sun, H. Guo, Calculated Vibrational States of Ozone up to Dissociation // J. Chem. Phys., 144, 074302 (2016) (doi:10.1063/1.4941559)