List of Publication


1. Y. Zeiri and M. Shapiro, 
      Semi-Empirical Potential Surfaces for Electron Transfer Reactions: The Li + FH and Li + F2 Reactions, 
      Chem. Phys. 31 217 (1978).

2. M. Shapiro and Y. Zeiri, 
      Semi-Empirical Potential Surfaces for the Alkali Hydrogen-Halide Reactions, 
      J.Chem. Phys. 70 5264 (1979).

3. Y. Zeiri and M. Shapiro, 
      Semi-Empirical Potential Surfaces for the Alkali Halogen Molecule Reactions, 
      J. Chem. Phys. 75 1170 (1981).

4.  R.B. Walker, Y. Zeiri and M. Shapiro, 
      A Quantum Mechanical Study of the collinear Li + FH Reaction, 
      J. Chem. Phys. 74 1763 (1981).

5. Y. Zeiri, M. Shapiro and E. Pollak, 
      A Classical Mechanical Study of the LiFH System, 
      Chem. Phys. 60 239 (1981).

6. A. Redondo, Y. Zeiri and W.A. Goddard III, 
      Classical Stochastic Diffusion Theory for Desorption of Atoms and Molecules from Solid Surfaces, 
      Phys. Rev. Lett. 49 1847 (1982).

7. Y. Zeiri and G.G. Balint-Kurti, 
      Theory of Alkali Halide Photofragmentation-Potential Energy Curves and Transition Dipole Moments, 
      J. Mol. Spec. 99 1 (1983).

8. Y. Zeiri, A. Redondo and W.A. Goddard III, 
      Classical Stochastic Diffusion Theory for Desorption from Solid Surfaces, 
      Surf. Sci. 131 221 (1983).

9. J.N. Allison, Y. Zeiri, A. Redondo and W.A. Goddard III, 
      Rates of Molecular Desorption from Solid Surfaces: Adsorption Site Dependence CO on Ni(100), 
      Chem. Phys. Lett. 97 387 (1983). 

10. Y. Zeiri, R. Tenne and M. Shapiro, 
      Dissociative Electron Transfer on Ionic Surfaces, 
      Chem. Phys. Lett. 99 11 (1983).


11. A. Redondo, Y. Zeiri, J.J. Low and W.A. Goddard III, 
      Application of transition State Theory to Desorption from Solid Surfaces: Amonia on Ni(111), 
      J. Chem. Phys. 79 6410 (1983).
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12. Y. Zeiri, R. Tenne and M. Shapiro, 
     Adsorption of Ions on Semiconductor Surfaces. I. Silver and Halide Ions on Silver Halides, 
     J. Chem. Phys. 80 5283 (1984).
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13. A. Redondo, Y. Zeiri and W.A. Goddard III, 
    Rates of Desorption from Solid Surfaces: Coverage Dependence, 
    Surf. Sci. 136 41 (1984).

14. Y. Zeiri, A. Redondo and W.A. Goddard III, 
    Desorption Rates at Electrode-Electrolyte Interfaces, 
    J. Electrochem. Soc. 131 1639 (1984).

15. W.A. Goddard III, J.J. Low, B. Olafson, A. Redondo, Y. Zeiri, M. Steigerwald, E.A. Carter, J.N. Allison and R. Chang, 
    The Role of Oxygen and Other Chemisorbed Species on Surface Processes for Metals and Semiconductors: Approaches to Dynamical Studies of    Surface Processes, 
    J. Electrochem. Soc. 130-c 123c (1983).

16. M. Asscher, G.A. Somorjai and Y. Zeiri, 
    Vibrational Excitation and Deexcitation Rates of Molecules Adsorbed on Metal Surfaces, 
    J. Chem. Phys. 81 1507 (1984).
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17. A. Redondo, Y. Zeiri and W.A. Goddard III, 
    Classical Stochastic Diffusion Theory for Thermal Desorption from Solid Surfaces, 
    J. Vac. Sci. Technol. B2 550 (1984).

18. V. Levy-Duval, M. Shapiro, Y. Zeiri and R. Tenne, 
    Adsorption of Atomic Hydrogen on LiF Surfaces, 
    Proceedings of the 17 Jerusalem Symposium on Quantum Chemistry and Biochemistry 
    Eds. B. Pullman, J. Jortner, A. Nitzan and B. Gerber, P. 149 (D. Reidel Publishing Company, 1984).

19. Y. Zeiri, E.S. Hood, A. Redondo and S. Solomon, 
    Nonequilibrium Distributions in Reactive Systems, 
    Phys. Rev. Lett. 55 634 (1985).

20. Y. Zeiri, J.J. Low and W.A. Goddard III, 
    A Theoretical Study of Collision induced Desorption Spectroscopy from Si(111) Surfaces, 
    J. Chem. Phys. 84 2408 (1986).
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21. M. Shapiro and Y. Zeiri, 
    Theory of Laser Catalyzed Reaction: I. Potential surfaces and Transition Dipoles in the Li + HCl Reaction, 
    J. Chem. Phys. 85 6449 (1986).
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22. J. Bloch and Y. Zeiri, 
    Laser Induced Morphology Changes in Thin Copper films, 
    J. Appl. Phys. 61 2637 (1987).

23. J. Bloch and Y. Zeiri, 
    Laser Annealing of Copper and Silicon Thin Films, 
    J. Vac. Sci. Technol. A5 1831 (1987).

24. Y. Zeiri, 
    Effective Equation of Motion for Gas-Solid Interactions, 
    J.  Chem. Phys. 86 7181 (1987).
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25. I. NoorBatcha, R.R. Lucchese and Y. Zeiri, 
    Monte Carlo Simulations of Gas-Phase Collisions in Rapid Desorption of Molecules from Surfaces, 
    J. Chem. Phys. 86 5816 (1987).
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26. Y. Zeiri, 
    Laser Induced Thermal Desorption: A Theoretical Study, 
    J. Chem. Phys, 88 3981 (1988).
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27. A. Kinrot, J. Bloch and Y. Zeiri, 
    Thermal Analysis of Laser Induced Thin Film Melting and Evaporation, 
    J. Phys. D, Appl. Phys. 21 975 (1988).

28. J. Bloch, Y. Zeiri and A. Venkert, 
    Solidification Mechanisms of Laser Annealed Thin Copper Films: Dual Phase Formation, 
    Appl. Phys. Lett., 52 874 (1988).
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29. I. NoorBatcha, R.R. Lucchese and Y. Zeiri, 
    Effects of Gas-Phase Collisions on Particles Rapidly Desorbed from Surfaces, 
    Phys. Rev. B36 4978 (1987).

30. J. Bloch, N. Shamir and Y. Zeiri, 
    Electron Auger Spectroscopy of CdCl Thin Films During Electron Beam Irradiation, 
    Surf. Sci., 202 227 (1988).

31. I. NoorBatcha, R.R. Lucchese and Y. Zeiri, 
    Anisotropic Translational Energy Distribution Due to Gas-Phase Collisions in Rapid Desorption of Molecules from Surfaces, 
    Surf. Sci., 200 113 (1988).

32. J. Bloch and Y. Zeiri, 
    Rapid Thermal Desorption of Di-atomic Molecules: A Theoretical Study, 
    Surf. Sci. 213 195 (1989).

33. I. NoorBatcha, R.R. Lucchese and Y. Zeiri, 
    Effects of Gas-Phase Collisions in Rapid Desorption of Molecules from Surfaces in the Presence of Coadsorbates, 
    J. Chem. Phys., 89 5251 (1988).
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34. J. Bloch, N. Shamir and Y. Zeiri, 
    The Interaction of an Electron Beam with CdCl Thin Film, 
    Appl. Phys. Lett., 52 1136 (1988).
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35. Y. Zeiri, 
    Theoretical Study of Collision Induced Desorption: N2 on W(100), 
    Surf. Sci., 231 404 (1990).

36. Y. Zeiri, U. Atzmony, J. Bloch and R.R. Lucchese, 
    Monte-Carlo Simulation of Laser Induced Chemical Vapor Deposition, 
    J. Appl. Phys., 69 4110 (1991).
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37. Y. Zeiri and R. Kosloff, 
    A Theoretical Study of Electron Hole Pair Formation Due to the Collision of an Atom with a Solid Surface, 
    J. Chem. Phys., 93 6890 (1990).
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38. Y. Zeiri and R.R. Lucchese, 
    Collision of Hyperthermal Atoms with a Solid Surface: I. Energy Dissipation in the Solid, 
    J. Chem. Phys., 94 4055 (1991).
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39. Y. Zeiri and R.R. Lucchese, 
    Collision Induced Desorption: II. Direct and Indirect Collider-Adsorbate Interactions, 
    Surf. Sci., 264 197 (1992).

40. J. Bloch, Y. Zeiri and R.R. Lucchese, 
    A Theoretical Study of Laser-Induced Chemical Vapor Deposition,
    Surf. Sci., 257 402 (1991).

41. D. Cohen, Y. Zeiri and M. Mintz, 
    Model Calculations of Hydrogen Absorption on Oxide Coated Metals: Effects of Surface and Diffusion Parameters 
    J. Alloys Comp. 184 11 (1992).

42. D. Cohen and Y. Zeiri, 
    A Theoretical Study of the Surface Diffusion of Large Molecules: I. n-alkane-type Chains on W(100)
    J. Chem. Phys., 97 1531 (1992).
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43. D. Cohen and Y. Zeiri, 
    Molecular Dynamics Study of the Surface Diffusion of n-alkane Like Adsorbates: II. Role of Chain Stiffness 
    Surf. SCi. 274 173 (1992).
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44. R. Kosloff and Y. Zeiri, 
    A Theoretical Study of Hydrogen Diffraction Following Photodissociation of Adsorbed Molecules
    J. Chem. Phys. 97 1719 (1992).
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45. V.J. Barclay, D.B. Jack, J.C. Polanyi and Y. Zeiri, 
    Dynamics of Surface-Aligned Pohotochemistry (Theory): II. Localised H-Atom Scattering in the HBr(ad)/LiF(001) + h$\nu $ System
    J. Chem. Phys., 97 9458 (1992)
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46. V.J. Barclay, J.C. Polanyi, Y. Zeiri and R. Kosloff, 
    Dynamics of Surface-Aligned Photochemistry: III. A Quantum Mechanical Study of the Photodissociation of HBr Adsorbed on LiF(001)
    J. Chem. Phys., 98 9185 (1993)
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47. V.J. Barclay, D.B. Jack, J.C. Polanyi and Y. Zeiri, 
    Dynamics of Surface-Aligned Photochemistry (Theory): IV. H-Atom Reactions in the HBr(ad)/LiF(001) + H System
    J. Phys. Chem., 97 12541 (1993).
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48. R.V. Weaver, Y. Zeiri and T. Uzer, 
    Competition Between Adsorbate fragmentation and Desorption on Laser-Heated Surfaces: A Stochastic Trajectory Study
    J. Chem. Phys., 98 5059 (1993).
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49. V.J. Barclay, W.-H. Hung, J.C. Polanyi, G. Zhang and Y. Zeiri, 
    Photochemistry of Adsorbed Molecules Part 13.-Localised Atomic Scattering in the Photolysis of HI/LiF(001)
    Faraday Discuss. Chem. Soc. 96 129 (1993).

50. Y. Zeiri, 
    Molecular Dynamics Study of the Surface Diffusion of Large Adsorbates: III. Role of Adsorbate Shape 
    Can. J. Chem. 72 813 (1994); J.C. Polanyi Special Issue.

51. Y. Zeiri, 
    Prediction of the Lowest Energy Structure of Clusters using  Genetic Algorithm
    Phys. Rev. E51 R2769 (1995).

52. Y. Zeiri, E. Fattal and R. Kosloff, 
    Application of Genetic Algorithm to the Calculation of Bound States and Local Density Approximations
    J. Chem. Phys. 102 1859 (1995).
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53. V.J. Barclay, W.-H. Hung, W.J. Keogh, R. Kuhnemuth, J.C. Polanyi, G. Zhang, Y. Zeiri, D.R. Jennison and Y.S. LiPhotochemistry of Adsorbed Molecules, XV. Localised Atomic Scattering in the Photolysis of HI/LiF(001) and HI/NaF(001)”, 
    J. Chem. Phys., 105 5005 (1996).
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54. R. Baer, Y. Zeiri and R. Kosloff, The Influence of Dimensionality on Deep Tunneling Rates: Astudy Based on the Hydrogen-Nickel System”, 
    Phys. Rev. B 54 R5287 (1996).
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55. Y. Zeiri, “
    Prediction of the Lowest Energy Structure of Clusters using Genetic Algorithm”, 
    Comp. Phys. Comm. 103 28 (1997).
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56. R. Baer, Y. Zeiri, R. Kosloff,Hydrogen transport in nickel(111)”, 
    Phys. Rev. B55 10952 (1997)
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57. R. Baer, Y. Zeiri and R. Kosloff, Quantum diffusion of Hydrogen and Deuterium on Ni(100)”, 
    Surf. Sci. Lett., 411 L783 (1998).
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58. L. Romm, Y. Zeiri and M. Asscher,Collision induced desorption of N2 from Ru(001)”, 
    J. Chem. Phys., 108 8605 (1998).
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59. Y. Zeiri, Structure and Dynamics of Cl and Br Ions and Atoms in Xe Clusters”, 
    J. Phys. Chem. A 102 2785 (1998).

60. G. Katz, Y. Zeiri and R. Kosloff,Non adiabatic charge transfer process of oxygen on metal surfaces”, 
    Surf. Sci., 425 1 (1999).
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61. Y. Zeiri, G. Katz, R. Kosloff, M.S. Topaler, D.G. Truhlar and J.C. Polanyi,Quantum Mechanism in the photodissociation of NaFH complex: A challenge to semiclassical analysis”, 
    Chem. Phys. Lett., 300 523 (1999).
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62. L. Romm, M. Asscher and Y. Zeiri,Molecular dynamics simulations of collision-induced desorption. I. Low coverage N2 on Ru(001)”, 
    J. Chem. Phys., 110 3153 (1999).
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63. L. Romm, M. Asscher and Y. Zeiri, Collision induced migration of adsorbates on surfaces”, 
    J. Chem. Phys. 110 11023 (1999).
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64. G. Katz, R. Kosloff and Y. Zeiri,  A theoretical study of hole induced  desorption”, 
    J. Chem. Phys., 111 7593 (1999).
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65. Y. Zeiri,Collision induced desorption by hot atoms: desorption of O2 from Ag(110)”, 
    J. Chem. Phys., 112 3408 (2000).
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66. G.R. Darling, Y. Zeiri and R. Kosloff, “
    Charge transfer reactions in atom scattering from ionic surface: A time-dependent wavepacket approach” 
    Faraday Discussion 117 41 (2000).
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67. Ronnie Kosloff, Gil Katz and Yehuda Zeiri,Dynamics of charge transfer states on metal surfaces: the competition between reactivity and quenching”, 
    Faraday Discussion 117 291 (2000).
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68. Micha Asscher, Leonid Romm and Yehuda Zeiri, Collision induced processes at the gas-surface interface” 
    Colloids and Surfaces (Israel-Poland conference), A208 187 (2002).
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69. Yehuda Zeiri Tracer surface diffusion at high pressures: molecular dynamics study”, 
    J. Chem. Phys., 113 3868 (2000).

70. F. Dubnikova, R. Kosloff, Y. Zeiri and Z. Karpas, A novel approach to detection of triacetone triperoxide (TATP): its structure and its complexes with ion” 
    J. Phys. Chem. A, 106 4951 (2002).
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71. G. Katz, K. Yamashita, Y. Zeiri and R. Kosloff,The Fourier method for tri-atomic systems in quest of the optimal coordinate system” 
    J. Chem. Phys. 116, 4403 (2002). [pdf]

72. Gil Katz, Yehuda Zeiri and Ronnie Kosloff,Quantum dissipative model for the collision induced ionization of I2 molecule over a diamond surface”, 
    Chem. Phys. Lett., 358. 284 (2002).
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73. Gil Katz, Yehuda Zeiri and Ronnie Kosloff,Three dimensional quantum time dependent study of the photodissociation dynamics of NaFH/D”, 
    Chem. Phys. Lett., 359 453 (2002).
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74. Gil Katz, Yehuda Zeiri and Ronnie Kosloff, 
    Abstractive dissociation of oxygen over Al(111): A non-adiabatic quantum model , 
    J. Chem. Phys., Submitted for publication.

75. G.R. Darling, R. Kosloff and Y. Zeiri, “
    Time-Dependent Quantum calculations of negative ion formation in scattering of atoms from Alkali-Halide surfaces”, 
    Surf. Sci., 528 84 (2003).
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76. Marcello Binetti, Olaf Wei?e, Eckart Hasselbrink, Gil Katz, Ronnie Kosloff and Yehuda Zeiri, 
    The role of nonadiabatic pathways and molecular rotations in the oxygen abstraction reaction on the Al(111) surface" 
    Chem. Phys. Lett. 373 366 (2003).
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Invited Papers

1.  J.C. Polanyi and Y. Zeiri, 
    Dynamics of Adsorbate Photochemistry 
    Chapter 25 in ''Laser Spectroscopy and Photochemistry on Metal Surfaces'' Edited by H.L. Dai and W. Ho (1996).

2.  Y. Zeiri, 
    Theoretical Studies of Surface Diffusion and of Photo-induced Surface Processes'' 
    Thematic issue of Computer Physics Communications on Gas-Surface Dynamics, 
    Edited by E. Vilallonga and H. Rabitz, Vol. 80, 200-241 (1994).

3.  Micha Asscher and Yehuda Zeiri “
    Surface processes Induced by collisions” 
    J. Phys. Chem. B., Feature Article, 107 6903 (2003).
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