Professor LEE Soo Ying
Internationally Refereed Papers
  1. Lee, Soo-Y and J C Light, On the quantum momentum method for the exact solution of the separable multiple well bound state and scattering problem. Chemical Physics Letters, 25 (1974): 435-438.
  2. Yuan, J M, Soo-Y Lee and J C Light, Reduced fermion density matrices. II. Electron density of Krypton. Journal of Chemical Physics, 61 (1974): 3394-3400.
  3. Lee, Soo Y and J C Light, Uniform semiclassical approximation to the electron density distribution. Journal of Chemical Physics, 63 (1975): 5274-5282.
  4. Lee, Soo Y and E J Heller, Time-dependent theory of Raman scattering. Journal of Chemical Physics, 71 (1979): 4777-4788.
  5. Lee, Soo-Y, The inhomogeneous Airy functions, Gi(z) and Hi(z). Journal of Chemical Physics, 72 (1980): 332-336.
  6. Lee, Soo-Y and E J Heller, Exact time-dependent wavepacket propagation: Application to the photodissociation of methyl iodide. Journal of Chemical Physics, 76 (1982): 3035-3044.
  7. Lee, Soo-Y, Semiclassical theory of radiation interacting with a molecule. Journal of Chemical Physics, 76 (1982): 3064-3074.
  8. Lee, Soo-Y, Placzek-type polarizability tensors for Raman and resonance Raman scattering. Journal of Chemical Physics, 78 (1983): 723-734.
  9. Lee, Soo-Y, R C Brown and E J Heller, Multidimensional reflection approximation: Application to the photodissociation of polyatomics. Journal of Physical Chemistry, 87 (1983): 2045-2053.
  10. Lee, Soo Y, The electron repulsion integral and the independent particle model for helium. Journal of Chemical Education, 60 (1983): 935-936.
  11. Lee, Soo-Y, Energy shift correction to the reflection approximation. Journal of Chemical Physics, 82 (1985): 4588-4594.
  12. Lee, Soo-Y, The hydrogen atom as a Morse oscillator. American Journal of Physics, 53 (1985): 753-757.
  13. Lee, Soo-Y, Potential energy surfaces and effects on electronic and Raman spectra. Journal of Chemical Education, 62 (1985): 561-566.
  14. Lee, Soo-Y and K S Chow, The effect of the damping constant on Raman excitation profiles. Journal of Raman Spectroscopy, 16 (1985): 386-396.
  15. Lee, Soo-Y, Theory of multidimensional wavepacket propagation. Chemical Physics, 108 (1986): 451-459.
  16. Lee, Soo-Y and S K Lim, Harmonic autocorrelation function: Application to diatomic photoelectron spectra. Journal of Chemical Physics, 88 (1988): 3417-3427.
  17. Lee, Soo-Y and R A Mathies, Polarizability theory and sum rules. Chemical Physics Letters, 151 (1988): 9-15.
  18. Lee, Soo-Y, W T Pollard and R A Mathies, Quasi-classical models of transition state absorption. Chemical Physics Letters, 163 (1989): 11-18.
  19. Lee, Soo-Y, W T Pollard and R A Mathies, Classical theory for real-time femtosecond probing of the NaI photodissociation. Journal of Chemical Physics, 90 (1989): 6146-6150.
  20. Lee, Soo-Y, W T Pollard and R A Mathies, Quantum theory for transition state absorption. Chemical Physics Letters, 160 (1989): 531-537.
  21. Lee, Soo-Y and C H Lai, A simple method to determine bond lengths and excited state surfaces from electronic-vibrational spectra. Chemical Physics Letters, 167 (1990): 255-262.
  22. Lee, Soo-Y, Time-frame viewpoint of resonance Raman enhancement of a nontoally symmetric vibration. Journal of Chemical Physics, 92 (1990): 6376-6383.
  23. Pollard, W T, Soo-Y Lee and R A Mathies, Wavepacket theory of dynamic absorption spectra in femtosecond pump-probe experiments. Journal of Chemical Physics, 92 (1990): 4012-4029.
  24. Lee, Soo-Y, Determination of excited state potential energy surfaces in the Franck-Condon region from electronic absorption spectra. Journal of Physical Chemistry, 94 (1990): 4420-4425.
  25. Lee, Soo-Y and T S C Lee, Spectral moment method versus least-squares Franck-Condon analysis for vibrationally resolved absorption spectra. Journal of Chemical Physics, 94 (1991): 5313-5323.
  26. Lee, Soo-Y and T S C Lee, A rapid method for determining excited state surface parameters and bond length in diatomic molecules and calculating wave functions for Franck-Condon factors using the quantum momentum method. Computers & Chemistry, 15 (1991): 215-223.
  27. Lee, Soo-Y, Simple results for Raman scattering, Journal of Molecular Structure, 266 (1992): 171-176.
  28. Lee, Soo-Y and T S C Lee, Useful results for the determination of excited state geometries from resonance Raman spectra: Application to inorganic complexes. Journal of Chemical Physics, 96 (1992): 5734-5745.
  29. Lee, Soo-Y, Relation between the vibrational wavepacket propagation formalism and the time-correlation function formalism for absorption and Raman scattering. Bulletin of the Chemical Society of Japan, 65 (1992): 1703-1706.
  30. Lee, Soo-Y, Time-dependent Hartree approximation applied to the photodissociation of ICN. Journal of Chemical Physics, 97 (1992): 227-235.
  31. Lee, Soo-Y, Derivation of the reflection principle in continuum resonance Raman scattering. Chemical Physics Letters, 203 (1993): 93-98.
  32. Lai, Y H, S M Lee, Soo-Y Lee and M Y Yi, Synthesis and conformational study of 1,1’-ethano-9,9’-bifluorenyl. Anti and gauche conformers of a 9,9’-bifluorenyl derivative and chair and twist conformers of a dibenzo-1,5-cyclooctadiene derivative. Tetrahedron, 49 (1993): 2437-2446.
  33. Lee, Soo-Y and Hau-Y Chang, Missing mode effect in resonance Raman excitation profiles. Journal of Chemical Physics, 100 (1994): 4056-4064.
  34. Lee, Soo-Y and R C K Yeo, A transform from absorption to Raman excitation profile. A time-dependent approach. Chemical Physics Letters, 221 (1994): 459-466.
  35. Lee, Soo-Y, Phase recovery and reconstruction of the Raman amplitude from the Raman excitation profile. Chemical Physics Letters, 245 (1995): 620-628.
  36. Lee, Soo-Y and Z W Feng, Comment on the inversion of Raman excitation profiles – Reply. Chemical Physics Letters, 260 (1996): 511-513.
  37. Lu, J and Soo-Y Lee, Theory of Raman scattering with pulses – Application to continuum Raman spectroscopy. Journal of Chemical Physics, 104 (1996): 8237-8244.
  38. Lu, J, Soo-Y Lee and K N Fan, Dynamical theory of spectroscopy with femtosecond pulse excitation (I) – Dynamics of absorption and emission processes. Science in China. Series A, Mathematics, Physics, Astronomy & Technological Sciences, 40 (1997): 958-966.
  39. Lu, J, Soo-Y Lee and K N Fan, Dynamical theory of spectroscopy with femtosecond pulse excitation (II) – Emission in direct dissociation. Science in China. Series A, Mathematics, Physics, Astronomy & Technological Sciences, 40 (1997): 1331-1339.
  40. Lee, Soo-Y, Z W Feng and R C K Yeo, Phase recovery from the Raman excitation profile, time domain information and transform theory. Journal of Raman Spectroscopy, 28 (1997): 411-425.
  41. Wu, K C and Soo-Y Lee, Ab initio calculations on the normal mode vibrations and the Raman and IR spectra of the metaborate ring. Journal of Physical Chemistry A, 101 (1997): 937-940.
  42. Yang C, Soo-Y Lee and H C Kang, An embedded cluster study of dimmer buckling on the Si(100) surface. Journal of Chemical Physics, 107 (1997): 3295-3299.
  43. Zhang, D H, J C Light and Soo-Y Lee, Quantum rate constant for the H2 + OH reaction with the centrifugal sudden approximation. Journal of Chemical Physics, 109 (1998): 79-86.
  44. Zhang, D H and Soo-Y Lee, Effects of reagent rotation on the dynamics of the H2 + OH reaction: A full dimension quantum study. Journal of Chemical Physics, 109 (1998): 2708-2716.
  45. Zhang, D H and Soo-Y Lee, Fully converged integral cross sections of diatom-diatom reactions and the accuracy of the centrifugal sudden approximation in the H2 + OH reaction. Journal of Chemical Physics, 110 (1999): 4435-4444.
  46. Zhang, D H, J C Light and Soo-Y Lee, Transition state wavepacket study of hydrogen diffusion on Cu (100) surface. Journal of Chemical Physics, 111 (1999): 5741-5753.
  47. Zhang, D H and Soo-Y Lee, Effects of reagent rotation and the accuracy of the centrifugal sudden approximation in the H2 + CN reaction. Journal of Chemical Physics, 112 (2000): 203-211.
  48. Zhang, D H, M A Collins and Soo-Y Lee, First principles theory for the H+H20, D2O reactions. Science, 290 (2000): 961-963.
  49. Zhang, D H, Soo-Y Lee and M Baer, Quantum mechanical integral cross sections and rate constant for the F+HD reaction. Journal of Chemical Physics, 112 (2000): 9802-9809.
  50. Yang, M, D H Zhang, M A Collins and Soo-Y Lee, Quantum dynamics on new potential surfaces for the H2O+OH?H2O+H reaction. Journal of Chemical Physics, 114 (2001): 4759-4762.
  51. Zhang, D H, M Yang and Soo-Y Lee, Branching ratio in the HD+OH reaction: A full-dimensional quantum dynamics study on a new ab initio potential energy surface. Journal of Chemical Physics, 114 (2001): 8733-8736.
  52. Yang, M, D H Zhang, M A Collins and Soo-Y Lee, Ab initio potential energy surfaces for the reaction H2 + OH ? H2O + H. Journal of Chemical Physics, 115 (2001): 174-178.
  53. Lee, C L, Y L Lam and Soo-Y Lee, Solid-phase combinatorial synthesis of benzothiazole and 2,3-dihydro-[1,5]-benzothiazepine derivatives. Tetrahedron Letters, 42 (2001): 109-111.
  54. Lee, C L, K P Chan, Y L Lam and Soo-Y Lee, Solid-phase combinatorial synthesis of 1,4-benzoxazin-3(4H)-one and 1,4-benzothiazin-3(4H)-one derivatives. Tetrahedron Letters, 42 (2001): 1167-1169.
  55. Chen, Y, Y L Lam and Soo-Y Lee, Solid-phase synthesis of pyridazine derivatives using polymer-bound sodium benzenesulfinate. Chemistry Letters, 3 (2001): 274-275.
  56. Feng Z W and Soo-Y Lee, Complex Raman amplitude recovery and dynamics from Raman excitation profile: Application to iodobenzene and azulene. Journal of Raman Spectroscopy, 32 (2001): 447-460.
  57. Lu, J, K N Fan and Soo-Y Lee, Dynamical theory of spectroscopy with pulse excitation in strong laser fields. Chemical Physics Letters, 345 (2001): 151-158.
  58. Zhang, D H, M Yang and Soo-Y Lee, Quantum dynamics of the D2 + OH reaction. Journal of Chemical Physics, 116 (2002): 2388-2394.
  59. Zhang, D H, M Yang and Soo-Y Lee, Breakdown of the spectator model for the OH bonds in studying the H + H2O reaction. Physical Review Letters, 89 (2002): 103201 (pp.1-4).
  60. Zhang, D H, M Yang, M A Collins and Soo-Y. Lee, Probing the transition state via the photoelectron and photodetachment spectroscopy of H3O-. Proceedings of the National Academy of Sciences of the United States of America, 99 (2002): 11579-11582.
  61. Yang, M, D H Zhang and Soo-Y Lee, A seven-dimensional quantum study of the H + CH4 reaction. Journal of Chemical Physics, 117 (2002): 9539-9542.
  62. Zhang, D H, M Yang and Soo-Y Lee, Accuracy of the centrifugal sudden approximation in the H + H2O reaction and accurate integral cross sections for the H + H2O ? H2 + OH abstraction reaction. Journal of Chemical Physics, 117 (2002): 10067-10072.
  63. Zhang, D H, D Xie, M Yang and Soo-Y Lee, State-to-state integral cross section for H + H2O ? H2 + OH abstraction reaction. Physical Review Letters, 89 (2002): 283203 (pp.1-4).
  64. Brouard, M, I Burak, S Marinakis, D Minayev, P O’Keeffe, C Vallance, F J Aoiz, L Banares, J F Castillo, D H Zhang, D Xie, M Yang, Soo-Y Lee and M A Collins, Cross section for the H + H2O abstraction reaction: Experiment and theory. Physical Review Letters, 90 (2003): 093201 (pp. 1-4).
  65. Yeh, K L, D Q Xie, D H Zhang, Soo-Y Lee and R Schinke, Time dependent wave packet study of the O2(v=0,j=0)+O exchange reaction. Journal of Physical Chemistry A, 107 (2003): 7215-7219.
  66. Lee, Soo-Y, D H Zhang, D W McCamant, P Kukura and R A Mathies, Theory of femtosecond stimulated Raman spectroscopy. Journal of Chemical Physics, 121 (2004): 3632-3642. [Selected for the Sept 2004 issue of Virtual Journal of Ultrafast Science. http://scitation.aip.org/dbt/dbt.jsp?KEY=VIRT05&Volume=3&Issue=9 ]
  67. Yoon, S W, D McCamant, P Kukura, R A Mathies, D H Zhang and S Y Lee, Dependence of lineshapes in femtosecond broadband stimulated Raman spectroscopy on pump-probe delay time. Journal of Chemical Physics, 122 (2005): 024505.
  68. Lu, Y P, D H Zhang and S Y Lee, A time-dependent wave packet study of the H-4 four-center reaction. Chemical Physics, 308 (2005): 217-224.
  69. Zhang, D H, W Z Bao, M H Yang and S Y Lee, Continuous configuration time-dependent self-consistent field method for polyatomic quantum dynamical problems. Journal of Chemical Physics, 122 (2005): 091101.
  70. Lee, S Y, S Yoon and R A Mathies, Femtosecond Broadband Stimulated Raman Spectroscopy. Journal of Physics: Conference Series 28 (2006) 36-41.
  71. Lu, Y P, S Y Lee and D H Zhang, A full dimensional time-dependent wave packet study for the H-4 four-centre, collision induced dissociation, and single exchange reactions: Reaction probabilities for J=0. Journal of Chemical Physics 124 (2006) Art. 011101.
  72. Zhang, L L, S Y Lee and D H Zhang, A test of the continuous configuration time-dependent self-consistent field (CC-TDSCF) method on the H + CH4 reaction. Journal of Physical Chemistry A 110 (2006) 5513-5519.
  73. Yang, M H, S Y Lee and D H Zhang, Seven-dimensional quantum dynamics study of the O(P3)+CH4 reaction. Journal of Chemical Physics, 126 (2007) Art. 064303.
  74. Sun, ZG, Z Jin, J Lu, D H Zhang and S Y Lee, Wave packet theory of dynamic stimulated Raman spectra in femtosecond pump-probe spectroscopy. Journal of Chemical Physics, 126 (2007) Art. 174104.[Selected for the June 2007 issue of Virtual Journal of Ultrafast Science. http://scitation.aip.org/dbt/dbt.jsp?KEY=VIRT05&Volume=6&Issue=6 ]
  75. Sun, ZG, S Y Lee and D H Zhang, Time-dependent quantum wave packet study of F + HCl and F + DCl reactions. Chinese Journal of Chemical Physics, 20 (2007) 365-371.
  76. Zhang, LL, Y P Lu, Lee S Y and D H Zhang, A transition state wave packet study of the H + CH4 reaction. Journal of Chemical Physics, 127 (2007) Art. 234313.
  77. Lin SY, Z G Sun, H Guo, D H Zhang, P Honvault, D Q Xie, and S Y Lee, Fully Coriolis-Coupled Quantum Studies of the H+O2 (vi=0-2, ji=0,1) ? OH + O Reaction on an Accurate Potential Energy Surface: Integral Cross Sections and Rate Constants. Journal of Physical Chemistry A, 112 (2008) 602-611.
  78. Sun, ZG, J Lu, D H Zhang and S Y Lee, Quantum theory of (femtosecond) time-resolved stimulated Raman scattering. Journal of Chemical Physics, 128 (2008) Art. 144114.[Selected for the May 2008 issue of Virtual Journal of Ultrafast Science. http://scitation.aip.org/dbt/dbt.jsp?KEY=VIRT05&Volume=7&Issue=5 ]
  79. Wang, X, W Dong, M Qiu, Z Ren, L Che, D Dai, X Wang, X Yang, Z Sun, B Fu, S Y Lee, X Xu and D H Zhang, HF(v’=3) forward scattering in the F + H2 reaction: Shape resonance and slow-down mechanism. Proceedings of the National Academy of Sciences of the United States of America, 105 (2008): 6227-6231.
  80. Sun, ZG, X Q Qiu, J Lu, D H Zhang and S Y Lee, Three-state model for femtosecond broadband stimulated Raman scattering. Journal of Raman Spectroscopy, 39 (2008): 1568-1577.
  81. Wang, X, W Dong, C Xiao, L Che, Z Ren, D Dai, X Wang, P Casavecchia, X M Yang, B Jiang, D Xie, Z G Sun, S Y Lee, D H Zhang, H J Werner, and M H Alexander, Science, 322 (2008): 573-576.
  82. Sun, ZG, B Fu, D H Zhang and S Y Lee, Theoretical Investigation of the Direct Observation of Anharmonic Coupling in CDCl3 in the Time Domain with Femtosecond Stimulated Raman Scattering. Journal of Chemical Physics, 130 (2009): Art. 044312-1 to 8. [Selected for the Feb 2009 issue of Virtual Journal of Ultrafast Science. http://scitation.aip.org/dbt/dbt.jsp?KEY=VIRT05&Volume=8&Issue=2]
  83. Sun, ZG, X Lin, C Xiao, S Y Lee and D H Zhang, A Reactant Coordinate Based Time-Dependent Wave Packet Method for Triatomic State-to-State Reaction Dynamics: Application to the H+O2 Reaction. Journal of Physical Chemistry A, 113 (2009): 4145-4154.
Chapters in Books
  1. Lee, Soo-Y, Time-dependent quantum-mechanical approach to photoabsorption and Raman scattering. In: Study of Fast Chemical Processes, II, pp. 569-585. India: Tata Institute of Fundamental Research, 1988.
  2. Lee, Soo-Y, Some applications of time-dependent wavepacket methods. In: Study of Fast Chemical Processes, II, pp. 587-609. India: Tata Institute of Fundamental Research, 1988.
  3. Lee, Soo-Y, Wavepacket model of dynamic dispersed and integrated pump-probe signals in femtosecond transition-state spectroscopy. In: Femtosecond Chemistry, Vol. 1, pp. 273-298. Weinheim: VCH Publishers, 1995. (Invited Chapter).
  4. Zhang DH, M Yang, M A Collins and S Y Lee, Reaction Dynamics of Polyatomic Systems: From A + BCD → AB + CD to X + YCZ3 → XY + CZ3. In: Theory of Chemical Reaction Dynamics. Eds. A. Lagana and G. Lendvay (Kluwer Academic Publishers, Netherlands, 2004) pp. 279-303.
  5. Zhang DH, M Yang, S Y Lee and M A Collins, First Principles Quantum Dynamical Study of Four-Atom Reactions, to appear in Modern Trends in Chemical Reaction Dynamics: Experiment and Theory (Part II), Chapter 9. (World Scientific Pub Co, Singapore, 2004).
Editorial work on journals

Lee, Soo-Y, Editor, Bulletin of the Singapore National Institute of Chemistry.
Volume 15, 1987
Volume 17, 1989
Volume 18, 1990
Volume 19, 1991
Volume 20, 1992
Volume 21, 1993