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[Return to Previous Listing]John Sabin

Professor, Department of Physics, University of Florida

Phone: (352) 392-1597

Fax: (352) 392-8722

2316 New Physics Building

http://www.qtp.ufl.edu/~sabin/

Education:

Ph.D., University of New Hampshire, 1968

Research Interests:

Research interests include theoretical studies of energy deposition in materials by swift ions. This includes studies of dipole and generalized oscillator strength distributions and full electron-nuclear dynamics studies of collisions from keV/amu to MeV/amu energies. Emphasis is on molecular and biomolecular targets. Other interests include theoretical prediction of the properties of molecules in high magnetic fields.

Publications List:

- J.R. Sabin, "Hydrogen Bonding in Simple -Electron Systems. I. Pyridinium-Pyridine," Int. J. Quantum Chem.
**2**, 23 (1968). - J.R. Sabin, "Hydrogen Bonding in Simple -Electron Systems. II. Pyridine-Pyrrol," Int. J. Quantum Chem.
**2**, 31 (1968). - J.R. Sabin, S.F. Fischer and G.L. Hofacker, "Proton-Phonon Coupling in a Hydrogen Bonded System," Phys. kondens. Materie
**8**, 268 (1969). - J.R. Sabin, S.F. Fischer and G.L. Hofacker, "S.C.F. Calculation for Proton- Phonon Coupling in a Linear Model of Ice," Int. J. Quantum Chem.
**3S**, 257 (1969). - J.R. Sabin, R.E. Harris, T.W. Archibald, P.A. Kollman and L.C. Allen, "Ab Initio MO-SCF Calculations on a Model of Anomolous Water," Theoret. Chem. Acta
**18**, 235 (1970). - J.R. Sabin, "Theoretical Study of the Bis(pyridine)iodine(I) Cation," J. Mol. Struct.
**7**, 407 (1971). - J.R. Sabin, "Hydrogen Bonds Involving Sulfur. I. The Hydrogen Sulfide Dimer," J. Am. Chem. Soc.
**93**, 3613 (1971). - J.R. Sabin, "Hydrogen Bonds Involving Sulfur. II. The Hydrogen Sulfide-Hydrosulfide Complex," J. Chem. Phys.
**54**, 4675 (1971). - M.A. Ratner and J.R. Sabin, "Symmetry Considerations Concerning d-Orbital Participation in Chemical Bonding of Second Row Elements," J. Am. Chem. Soc.
**93**, 3542 (1971). - T. Achibald and J.R. Sabin, "Theoretical Investigation of the Electronic Structure and Properties of N
_{3}, N_{3}^{-}, N_{3}^{+}," J. Chem. Phys.**55**, 1821(1971) - J.R. Sabin, "Some Calculations of the Lighter Bis(pyridine)Halogen(I) Cations," J. Mol. Struct.
**11**, 33 (1972). - J.R. Sabin "A Comment Concerning S-H-S Type Hydrogen Bonds," Int. J. Quantum Chem.
**5S**, 133 (1971). - J.R. Sabin, "CNDO Study of the Properties of Ionic Defect Structure in a Model One-Dimensional Hydrogen-Bonded Chain," J. Chem. Phys. 56,
**45**(1972). - J.R. Sabin and H. Kim, "A Theoretical Study of the Structure and Properties of Carbon Trioxide," Chem. Phys. Letters
**11**, 593 (1971). - J.R. Sabin and H. Kim, "Ab Initio Calculation of the Electronic Structure of Carbon Suboxide," J. Chem. Phys.
**56**, 2195 (1972). - J.W.D. Connolly and J.R. Sabin, "Total Energy in the Multiple Scattering Formalism: Application to the Water Molecule," J. Chem Phys.
**56**, 5529 (1972). - M.A. Ratner and J.R. Sabin, "FrÃƒÂ¶hlich Polaron Model for Trapping of Compton Electrons in Hydrogen-Bonded Glasses," Chem. Phys. Letters
**14**, 92 (1972). - J.R. Sabin, D.P. Santry and K. Weiss, "CNDO Molecular Orbital Calculations. On the Invariance of Methods for Second Row Elements," J. Am. Chem. Soc.
**94**, 6651 (1972). - J.R. Sabin, "A Model Study of the Interaction of a Hydrogen Bond with a p-Electron System," Theoret. Chem. Acta
**27**, 69 (1972). - P. Lindner and J.R. Sabin, "Electron Distribution in a Short A-Type Hydrogen Bond," Int. J. Quantum Chem.
**6S**, 301 (1972). - W.R. Oegerle and J.R. Sabin, "On the CNDO Determination of the Molecular Conformation and Properties of Glycine and Its Zwitterion," J. Mol. Struct.
**15**, 131 (1973). - J.R. Sabin and M.A. Ratner, "The Wave Mechanical Treatment of HydrogenBonded Systems," from Wave Mechanics--The First Fifty Years, S.S. Chissick, W.C. Price and T. Ravensdale, eds., Butterworths, pp. 72-87, 1973.
- J.R. Sabin, "On the Barrier to Internal Rotation in Phosphineborane," Chem. Phys. Letters
**20**, 212 (1973). - H. Kim and J.R. Sabin, "An Ab Initio Calculation of the Molecular Structure and Properties of Hypofluorous Acid," Chem. Phys. Letters 20,
**215**(1973). - M. Vuceli?, Y. Ãƒâ€“hrn and J.R. Sabin, "Ab Initio Calculation of the Vibrational and Electronic Properties of Carbon Dioxide," J. Chem. Phys.
**59**, 3003 (1973). - M.A. Ratner, J.R. Sabin and E.E. Ball, "SCF Calculation of the Effective Parameters for the Hubbard Model of TCNQ Charge-Transfer Salts," Mol. Phys.
**26**, 1177 (1973). - P. Lindner, Y. Ãƒâ€“hrn and J.R. Sabin, "A Semi-Empirical Investigation of the Electronic Structure and Stability of the Oxycumulenes," Int. J. Quantum Chem.
**7S**, 261 (1973). - N.H.F. Beebe and J.R. Sabin, "An Ab Initio Study of the Electronic Structure of C
_{2}O_{2}," Chem. Phys. Letters**24**, 389 (1974). - N. Rosch, G.L. Hofacker and J.R. Sabin, "Ion-Solvent Cluster in the Vicinity of an Electrode: Semiempirical SCF Model Including Image Forces," J. Chem. Phys.
**60**, 4009 (1974). - R.L. Tyner, W.M. Jones, Y. Ohrn and J.R. Sabin, "Semiempirical Calculations on Phenylcarbene, Cycloheptatrieylidene, and Cycloheptatetraene and Their Benzo-Annelated Derivatives," J. Am. Chem. Soc.
**96**, 3765 (1974). - T.C. Jao, N.H.F. Beebe, W.B. Person and J.R. Sabin, "Molecular Polarizability Estimates for Vibrational Spectral Interpretation," Chem. Phys. Letters
**26**, 474 (1974). - P. Lindner and J.R. Sabin, "Localized Orbitals in Hydrogen Bonded Systems," Chem. Phys. Letters
**27**, 214 (1974). - M.A. Ratner, J.R. Sabin and E.E. Ball, "SCF Calculations of Some Electronic Properties of Tetrathiofulvalene and of Some Methyl-Substituted Tetrathiofulvalenes," Chem. Phys. Letters
**28**, 393 (1974). - N.M. Witriol, J.D. Stettler, J.R. Sabin and S.B. Trickey, "CNDO Calculations of Intermolecular V-T and V-V Potentials. The CO
_{2}-N_{2}Systems," Chem. Phys. Letters**27**, 540 (1974). - J. Cornelius and J.R. Sabin, "A CNDO Estimate of the Relative Affinities of Taurine and Isethionic Acid for Alkali Metal Ions," Int. J. Quantum Chem.
**QBS1**, 43 (1974). - J.R. Sabin, J.P. Worth and S.B. Trickey, "Cohesive Energy and the P-V Relation for fcc Neon in Two Variants of the Xa Model," Phys. Rev. B
**11**, 3658 (1975). - N.M. Witriol, J.D. Stettler, J.R. Sabin and S.B. Trickey, "Investigtion of the Computation of V-T and V-V Potentials," IEEE J. Quantum Elect.
**QE-11**, 717 (1975). - N.M. Witriol, J.D. Stettler, J.R. Sabin and S.B. Trickey, "CO
_{2}-N_{2}Intermolecular V-T and V-V Potentials via CNDO," J. Chem. Phys. 63, 3263 (1975). - J.R. Sabin and S.B. Trickey, "Comparison of Atomic Compton Profiles Obtained from Four Model Local Density Functionals," J. Chem. Phys. B
**8**, 2593 (1975). - G. Born and J.R. Sabin, "Ab Initio Calculation of Some Electronically Excited States of a Hydrogen-Bonded System: A Preliminary Report," Int. J. Quantum Chem.
**QBS2**, 259 (1975). - J. Rychlewski and J.R. Sabin, "Hydrogen Bonding in Linear (LiH)
_{2}," Chem.Phys. Letters 37,**180**(1976). - J.R. Sabin, "A Semi-Empirical Study of the Structural Effects of Ionic Defect Formation in a Model -Helical System," from Quantitative Structure-Activity Relationships, M. Tichy, ed., Hungarian Acad. Science, Budapest, p.199 (1976)
- M.A. Ratner and J.R. Sabin, "On Proton Mobilities in Individual Hydrogen Bonds," from Quantum Science, Methods and Structure, J.-L. Calais,
*et al*., eds., Plenem Press, p. 577 (1976). - J.W. Mintmire and J.R. Sabin, "Intermolecular Potential Studies of Hydrogen Molecule Interactions with Rare-Gas Atoms," Int. J. Quantum Chem.
**10S**, 213 (1976). - M.A. Ratner, J.R. Sabin and S.B. Trickey, "Applications of Model Hamiltonians to the Electron Dynamics of Organic Charge Transfer Salts," from The Uncertainty Principle and the Foundations of Quantum Mechanics, W.C. Price and S.S. Chissick, eds., p. 461, Wiley (1977).
- N.M. Witriol, J.D. Stettler, M.A. Ratner, J.R. Sabin and S.B. Trickey, "A Systematic Treatment of Quantum Mechanical Reaction Coordinates," J. Chem. Phys.
**66**, 1141 (1977). - S.F. Abdulnur and J.R. Sabin, "Double Minimum Bending Potentials for AB
_{2}-Type Molecules in the CNDO Approximation," Fla. Sci.**40**, 73 (1977). - M.A. Ratner and J.R. Sabin, "Some Symmetry Considerations Concerning the Role of Atomic d-Orbitals in Chemical Bonds: Discussion and Some Calculational Examples," J. Am. Chem. Soc.
**99**, 3954 (1977). - B.I. Dunlap, J.W.D. Connolly and J.R. Sabin, "On the Applicability of LCAO-Xa Methods to Molecules Containing Transition Metal Atoms: The Nickel Atom and Nickel Hydride," Int. J. Quantum Chem.
**11S**, 81 (1977) - M.A. Ratner, A.A. Frost, S. Topiol and J.R. Sabin, "Comparison of FSGO, Hartree-Fock-Roothaan and Pseudopotential Calculations for Li
_{2}," J. Chem. Soc. Faraday II**74**, 324 (1978). - V.H. Smith and J.R. Sabin, "The Compton Profile as a Criterion for the Choice of the Local Exchange Parameter ," J. Phys. B: Atom. Molec. Phys.
**11**, 385 (1978). - W.J. Janis, P. Kaijser, J.R. Sabin and V.H. Smith, Jr., "The Influence of Polarization Functions on the Directional Compton Profiles of Water," Mol. Phys.
**37**, 463 (1979). - E.E. Ball, M.A. Ratner and J.R. Sabin, "The Role of d-Orbital Basis Functions in the Electronic Structure Description of Molecules: Systems Containing Si, P, and Cl," Chemica Scripta
**12**, 128 (1977); [Erratum, Chemica Scripta**13**, 203 (1978)]. - M.J. Ondrechen, M.A. Ratner and J.R. Sabin, "Electron Transfer in Fixed-Nuclei Systems: A Comparison of Propagator Descriptions," J. Chem. Phys.
**71**, 2244 (1979). - R. Lozes and J.R. Sabin, "Excited Electronic States of a Hydrogen Bond: Bifluoride Ion," Int. J. Quantum Chem.
**16**, 273 (1979) - B.I. Dunlap, J.W.D. Connolly and J.R. Sabin, "On Some Approximations In Applications of Xa Theory," J. Chem. Phys. 71, 3396 (1979).
- B. Crist, M.A Ratner, A.L. Brower and J.R. Sabin, "Ab Initio Calculations of the Deformation of Polyethylene," J. Appl. Phys.
**50**, 6047 (1979). - B.I. Dunlap, J.W.D. Connolly and J.R. Sabin, "On First Row Diatomic Molecules and Local Density Models," J. Chem. Phys.
**71**, 4993 (1979). - J.W. Mintmire and J.R. Sabin, "A Comparison of the LCAO-Xa Method with the Hartree-Fock and Multiple Scattering-Xa Methods on Carbon Monoxide," Chem. Phys.
**50**, 91 (1980). - A.L. Brower, J.R. Sabin, B. Crist and M.A. Ratner, "Ab Initio Molecular Orbital Studies of Polyethylene Deformation," Int. J. Quantum Chem.
**18**, 651 (1980). - P. Kaijser and J.R. Sabin, "A Comparison Between LCAO-Xa and Hartree-Fock Wavefunctions for Momentum Space Properties of Ammonia," J. Chem. Phys.
**74**, 559 (1981). - J.W. Mintmire and J.R. Sabin, "Local Density Functional Methods in Two Dimensionally Periodic Systems. I. The Atomic Hydrogen Monolayer," Int. J. Quantum Chem.
**S14**, 702 (1980). - R.L. Lozes, J.R. Sabin and J. Oddershede, "On the Carbon Suboxide Bending Potential (n
_{7})," J. Mol. Spectrosc.**86**, 357 (1981). - C.Th. Pedersen, J. Oddershede and J.R. Sabin, "Semiempirical Studies on 1,2- and 1,3-Tetrathiofulvalenes," Int. J. Quantum Chem.
**20**, 369 (1981). - C.Th. Pedersen, J. Oddershede and J.R. Sabin, "The Stability of the Carbenes from 1,2-Dithiole and 1,3-Dithiole in Relation to the Synthesis of 1,1, 3,3- and 1,1, 2,2-Tetrathiafulvalenes," J.C.S. Perkin II, 1062 (1981).
- J.W. Mintmire, J.R. Sabin and S.B. Trickey, "Local-Density-Functional Methods in Two-Dimensionally Periodic Systems. Hydrogen and Beryllium Monolayers," Phys. Rev. B
**26**, 1743 (1982). - J. Oddershede and J.R. Sabin, "X-ray Scattering Factors, Compton Profiles, and Shell Corrections from Numerical Atomic Wavefunctions," Chem. Phys.
**71**, 161 (1982). - J.R. Sabin and J. Oddershede, "Shell Corrections to Electronic Stopping Powers from Orbital Mean Excitation Energies," Phys. Rev. A
**26**, 3209 (1982). - R.L. Lozes and J.R. Sabin, "Localized Electronic Excitation in a Hydrogen Bond," Int. J. Quantum Chem.
**QBS9**, 289 (1982). - J. Oddershede and J.R. Sabin, "The Use of Modified Virtual Orbitals in Perturbative Polarization Propagator Calculations," J. Chem. Phys.
**79**, 2295 (1983). - V.H. Smith, Jr., J.R. Sabin, E. Broclawik and J. Mrozek, "The Electronic Structure of the Trisulfur Trinitride Anion," Inorg. Chem. Acta
**77**, L101 (1983). - J. Oddershede, J.R. Sabin and P. Sigmund, "Predicted Z
_{2}Structure and Gas-Solid Differences in Low-Velocity Stopping Power of Light Ions," Phys. Rev. Lett.**51**, 1332 (1983). - J.R. Sabin and J. Oddershede, "Electronic Stopping Powers for Low Projectile Velocities," Phys. Rev. A
**29**, 1757 (1984). - B. Crist, J. Oddershede, J.R. Sabin, J.W. Perram and M.A. Ratner, "Polymer Fracture - A Model for Chain Scission," J. Poly. Sci. Poly.Phys.
**22**, 881 (1984). - J.R. Eyler, J. Oddershede, J.R. Sabin, G.H.F. Diercksen and N.E. Gruner, "Excitation Energy of Linear C
_{3}H_{3}^{+}. Can This Ion Be Detected by Laser-Induced Fluorescence in Flames?" J. Phys. Chem.**88**, 3121 (1984). - J.R. Sabin and S.B. Trickey, "On the Systematic Assessment of Correlation Effects in Local Density Models," in Local Density Approximations in Quantum Chemistry and Solid State Physics, J.P. Dahl and J. Avery, eds., p. 333, (Plenum, 1984).
- J. Oddershede and J.R. Sabin, "Orbital and Whole Atom Stopping Power and Shell Corrections for Atoms with Z < 36," At. Dat. Nuc. Dat. Tables
**31**, 275 (1984). - H. Jorg, N. Rosch, J.R. Sabin and B.I Dunlap, "Basis Sets in the LCAO-Xa Method. On the Use of Bond-Centered Basis Functions in Second-RowHomonuclear Diatomics." Chem. Phys. Lett.
**114**, 529 (1985). - G.H.F. Diercksen, N.E. Gruner, J. Oddershede and J.R. Sabin, "The Structure of Si
_{2}C and Si_{3}," Chem. Phys. Lett.**117**, 29 (1985). - J.R. Sabin, J. Oddershede and P. Sigmund, "On the Proton Stopping Power Maximum in Gasses and Vapours," Nuc. Inst. Meth. B
**12**, 80 (1985). - J. Oddershede, J.R. Sabin, G.H.F. Diercksen and N.E. Gruner, "The Structure and Spectrum of SiC
_{2}," J. Chem. Phys. 83, 1702 (1985). - J.R. Sabin, J. Oddershede, G.H.G. Diercksen and N.E. Gruner, "The Calculated Electronic Excitation Spectra of Si
_{2}C and Si_{3}," J. Chem. Phys.**84**, 354 (1986). - J.R. Sabin and J. Oddershede, "Theoretical Low Energy Stopping Powers: Effects of Sample Phase," Int. J. Quantum Chem.
**S19**, 733 (1985). - G.H.F. Diercksen, N.E. Gruner, J.R. Sabin, and J. Oddershede, "Structures and Spectra of Triatomic Silicon-Carbon Compounds," Int. J. Quantum Chem.
**S19**, 735 (1985). - J. Geertsen, J. Oddershede, and J.R. Sabin, "Calculation of Molecular Mean Excitation Energies via the Polarization Propagator Formalism: H
_{2}and H_{2}O," Phys. Rev. A**34**, 1104 (1986). - J. Oddershede and J.R. Sabin, "Stopping Powers from Velocity Distributions Derived from Compton Profiles," Phys. Rev. A
**35**, 3283 (1987). - J.R. Sabin and J. Oddershede, "Calculated Stopping Cross Sections for Diamond and Solid Silicon and Germanium," Nucl. Inst. Meth. B
**24/25**, 339 (1987). - J.R. Sabin and J. Oddershede, "Theoretical Stopping Cross Sections for C-H, C-C and C=C Bonds," Nuc. Inst. Meth. B
**27**, 280 (1987). - J. Oddershede, J.R. Sabin and G.H.F. Diercksen, "Stability andConformation of Silicon-Carbon Compounds. A Case study of SiC
_{2}, Si_{2}C, and Si_{3}," in Understanding Molecular Properties, Aa. Hansen, J. Avery and J. P. Dahl, eds., p.465 (Plenum, 1987). - A. Sadlej, G.H.F. Diercksen, J. Oddershede and J.R. Sabin, "How Reliable is the Theoretical structure of SiC
_{2}?," Chem. Phys.**122**, 297 (1988). - J. Oddershede, J.R. Sabin, G.H.F. Diercksen and N.E. Gruner, "Calculation of the Radiative Lifetime of BH in the Polarization Propagator Formalism," Chem. Phys.
**115**, 15 (1987). - J. Oddershede and J.R. Sabin, "Calculation of Rotational g-Factors and Magnetic Susceptabilities of H
_{3}^{+}," Chem. Phys.**122**, 291 (1988). - J.R. Sabin and J. Oddershede, "Stopping Powers and Mean Excitation Energies of the Transition Metals from Iron to Zinc," Phys. Rev. A
**39**, 1033 (1989). - J. R. Sabin and J. Oddershede, "Predicted Phase Differences in Proton Stopping by Alkali Metal Targets," Nucl. Inst. and Meth. B
**36**, 249 (1989). - J. Oddershede and J.R. Sabin, "Bragg Rule Additivity of Bond Stopping Cross Sections," Nucl. Inst. and Meth. B
**42**, 7 (1989). - S.B. Trickey, D.E. Meltzer and J.R. Sabin, "Calculation of Stopping Powers in Ordered Ultra-Thin Films," Nucl. Inst. and Meth. B
**40/41**, 321 (1989). - J. Oddershede and J.R. Sabin, "The Effect of Correlation on the Mean Excitation Energy of Beryllium," Phys. Rev. A
**39**, 5565 (1989). - J. Oddershede and J.R. Sabin, "On the Orbital Implementation of the Kinetic Theory of Stopping," Int. J. Quantum Chem.
**QC23**, 557 (1989). - J.R. Sabin and J. Oddershede, "A Comment on the Abstraction of Mean Excitation Energies from Experimental Reduced Stopping Powers," Nucl. Inst. and Meth. B
**44**, 253 (1990). - D.E. Meltzer, J.R. Sabin and S.B. Trickey, "Calculation of Mean Excitation Energies and Stopping Cross Sections in the Orbital Local Plasma Approximation," Phys. Rev. A
**41**, 220 (1990). [Erratum,**42**, 666 (1990)]. - J. Oddershede and J.R. Sabin, "Mean Excitation Energy and Moments of the Dipole Oscillator Strength Distribution of Closed Shell Aluminum Ions," Nucl. Inst. and Meth. B
**48**, 34 (1990) - J.R. Sabin, J. Oddershede and G.H.F. Diercksen, "Moments of the Dipole Oscillator Strength Distribution and Mean Excitation Energies of Helium," Phys. Rev. A
**42**, 1302 (1990). - J.Z. Wu, J.R. Sabin, S.B. Trickey and J.C. Boettger, "Mono- and Dilayer Analogues of Crystalline Atomic Hydrogen," Int. J. Quantum Chem.
**S24**, 873 (1990). - J. Oddershede and J.R. Sabin, "Polarization Propagator Calculations of Spectroscopic Properties of Molecules," Int. J. Quantum Chem.
**39**, 371 (1991). - P. Jensen, J. Oddershede and J.R. Sabin, "Geometric Dependence of the Mean Excitation Energy and Spectral Moments of Water," Phys. Rev. A
**43**, 4040 (1991). - G.H.F. Diercksen, J. Oddershede, I. Paidarova and J.R. Sabin, "Calculation of the Isotropic and Anisotropic Spectral Moments of the Dipole Oscillator Strength Distribution of N
_{2}," Int. J. Quantum Chem.**39**, 755 (1991). - J. Geertsen, J. Oddershede and J.R. Sabin, "Quadrupole Polarizability and Spectral Moments of the Quadrupole Oscillator Strength Distribution of N
_{2}," Mol. Phys. 72, 1267 (1991). - J.Z. Wu, S.B. Trickey, J.R. Sabin and D.E. Meltzer, "Stopping of Swift Projectiles in Material Thin Films: Hydrogen," Nucl. Inst. and Meth. B
**56/57**, 340 (1991). - J.R. Sabin and J. Oddershede, "Status of the Calculation of the Energy Loss of Swift Ions in Molecules," Nucl. Inst. and Meth. B
**64**, 678 (1992). - J.Z. Wu, S.B. Trickey, J.R. Sabin and J.C. Boettger, "Structure, Energetics, and Molecular-to-Atomic-Ordering Transitions in Hydrogen Thin Films," Phys. Rev. B
**45**, 8610 (1992). - E.H. Mortensen, J. Oddershede and J.R. Sabin, "Polarization Propagator Calculations of Generalized Oscillator Strengths and Stopping Cross Sections of He," Nucl. Inst. and Meth. B
**69**, 24 (1992). - S.P.A. Sauer, J.R. Sabin and J. Oddershede, "Directional Characteristics of the Moments of the Dipole Oscillator Strength Distribution of Molecules: H
_{2}and H_{2}O," Phys. Rev. B47, 1123 (1993). - W.A. Parkinson, J.R. Sabin and J. Oddershede, "On the Uncorrelated Reference for Calculation of Properties, "Theo. Chim. Acta
**86**, 167 (1993). - J.Z. Wu, S.B. Trickey and J.R. Sabin, "Proton Stopping in Ultrathin Lithium Films," Nucl. Inst. and Meth. B
**79**, 206 (1993). - D.E. Meltzer, J.R. Sabin, S.B. Trickey and J.Z. Wu, "Density Decomposition Options in the Orbital Local Plasma Approximation," Nucl. Inst. and Meth. B
**82**, 493 (1993). - J.Z. Wu, S.B. Trickey and J.R. Sabin, "Electronic Stopping Power for Protons in an LiF Monolayer," Int. J. Quantum Chem.,
**QC27**, 219 (1993). - J.R. Sabin, J. Oddershede and I. Paidarova, "An Estimate of the Temperature Dependence of the Stopping Cross Section in Molecular Targets," Nucl. Inst. and Meth. B
**93**, 161 (1994). - S.B. Trickey, J.Z. Wu and J.R. Sabin, "Materials Specificity, Quantum Length Scales, and Stopping Powers," Nucl. Inst. and Meth. B
**93**, 186 (1994). - J.I. Juaristi, J.Z. Wu, J.A. Nobel, S.B. Trickey and J.R. Sabin, "On the Metallization of the LiF Monolayer, "Solid State Comm.
**91**, 957 (1994). - J.A. Nobel, J.R. Sabin and S.B. Trickey, "Theoretical Ion Implantation Profiles for Low Energy Protons under Channeling Conditions," Int. J. Quantum Chem.
**QC28**, 283 (1994). - J.Z. Wu, S.B. Trickey, J.R. Sabin and J.A. Nobel, "Energy Deposition of Protons in Allotropic Carbon Ultra-Thin Layers, "Int. J. Quantum Chem.
**QC28**, 299 (1994). - H.H. Andersen and J.R. Sabin, "Introduction" to the Topical Issue of Nucl. Inst. and Meth. on Target Aggregation and Projectile Charge States, Nucl. Inst. and Meth. B
**93**, v (1994). - J.R. Sabin, I. Paidarova and J. Oddershede, "On the Relative Importance of Temperature and Isotope Effects on the Dipole Oscillator Strength Distribution of H
_{2}," Theoret. Chim. Acta, 89, 375 (1994). - S.B. Trickey and J.R. Sabin, "Reply to: Note on Stopping Power and Statistics of Particle Penetration," Nucl. Inst. and Meth. B
**95**, 480 (1995). - J.Z. Wu, S.B. Trickey, J.R. Sabin and J.C. Boettger, "CalculatedProperties of a Prototypical Ionic Monolayer," Phys. Rev. B
**51**, 14576 (1995). [Erratum,**58**, 4182 (1998)]. - A.C. Diz, Y. Ohrn and J.R. Sabin, "Dynamic Charge States and Energy Deposition of Swift Helium Ions in Neon," Nucl. Inst. and Meth. B
**96**, 633 (1995). - J.A. Nobel, J.R. Sabin and S.B. Trickey, "Simulation of Ion Implantation in Si for 0.25 keV H
^{+}under Channeling Conditions," Nucl. Inst. And Meth. B**99**, 632 (1995). - H.H. Mikkelsen, J. Oddershede, J.R. Sabin and E. Bonderup, "A Bethe Theory for Directional Dependence of Stopping by Molecules," Nucl. Inst. and Meth. B
**100**, 451 (1995). - S.P.A. Sauer, J.R. Sabin and J. Oddershede, "Calculated Molecular Mean Excitation Energies for Some Small Molecules," Nucl. Inst. and Meth. B
**100**, 458 (1995). - G.A. Aucar, J. Oddershede and J.R. Sabin, "Relativistic Extension of the Bethe Sum Rule," Phys. Rev. A
**52**, 1054 (1995). - S.P. Apell, J.R. Sabin and S.B. Trickey, "Prediction of Crystalline Properties from Ultrathin Layered Systems: Energy Deposition," Int. J. Quantum Chem.
**S29**, 153 (1995). - Y. Ãƒâ€“hrn and J. R. Sabin, "Obituary: Jean-Louis Calais," Phys. Today
**49**, 82 (1995). - J.R. Sabin and J. Oddershede, "Directional Characteristics of the Generalized Oscillator Strengths for some Low Lying Transitions in H
_{2}," Nucl. Inst. and Meth. B115, 79 (1996). - J.R. Sabin, "Energy Deposition of Swift Alpha's in Neon: An Electron Nuclear Dynamics Study," Adv. Quantum Chem.
**28**, 107 (1997). - R. Cabrera-Trujillo, S.A. Cruz, J. Oddershede, and J.R. Sabin, "A Bethe Theory of Stopping Incorporating Electronic Excitation of Partially Stripped Projectiles," Phys. Rev. A
**55**, 2864 (1997). [Erratum: Phys. Rev. A**59**, 4850 (1999)]. - S.P. Apell, J.R. Sabin, and S.B. Trickey, "Simple Physical Model for Layer-Number Dependences of Proton Stopping in Ultra-This Films," AIP Proceedings
**CP392**, 1369 (1997). - E.K. Dalskov, J. Oddershede, and J.R. Sabin, "Generalized Oscillator Strengths for Calculation of Molecular Stopping Properties, Some Preliminary Results: CO," AIP Proceedings
**CP392**, 1373 (1997). - K. Runge and J.R. Sabin,, "Introduction to the Workshop on Properties of Molecules in Strong Magnetic Fields," Int. J. Quantum Chem.
**64**, 495 (1997). - K. Runge and J.R. Sabin, "Properties of Molecules in High Magnetic Fields: H
_{2}^{+}, H_{2}, and LiH," Int. J. Quantum Chem.**64**, 561 (1997). - S.P. Apell, J.R. Sabin, and S.B. Trickey, "Surface Stopping," Phys. Rev. A
**56**, 3769 (1997). - J.C. Boettger, J.R. Smith, U. Birkenheuer, N. Rosch, S.B. Trickey, J.R. Sabin and S.P. Apell, "Comment on Extracting Convergent Surface Formation Energies from Slab Calculations," J. Phys.: Condensed Matter
**10**, 893 (1998). - J.E. Crow, J.R. Sabin and N.S. Sullivan, "The National High Magnetic Field Laboratory - a Precis," in Atoms and Molecules in Strong External Fields, P. Schmelcher and W. Schweizer, eds., Plenum Press, p. 77 (1998).
- K. Runge and J.R. Sabin, "Electronic Properties of Molecules in High Magnetic Fields: Hypermagnetizabilities of H
_{2}," in Atoms and Molecules in Strong External Fields, P. Schmelcher and W. Schweizer, eds., Plenum Press, p.283 (1998). - R. Cabrera-Trujillo, J.R. Sabin, Y. Ãƒâ€“hrn , and J. Oddershede, "Oscillator Strength Sum Rules with an External Magnetic Field," Phys. Rev. A
**57**, 3115 (1998). - J.R. Sabin and J. Oddershede, "Polarization Propagator Calculations of Molecular Generalized Oscillator Strengths," Pol. J. Chem.
**72**, 1376 (1998). - S.P. Apell, S.B. Trickey, and J.R. Sabin, "A Geometrical Basis for Molecular Stopping Anisotropy," Phys. Rev. A
**58**, 4616 (1998). - J. Wang, R.J. Mathar, S.B. Trickey and J.R. Sabin, "Momentum Density Effects upon Electronic Stopping of Elemental Solids," J. Phys. C
**11**, 3973 (1999). - S.P. Apell and J.R. Sabin, "Energy Deposition in Fullerene-Type Nano-Structures," AIP Proceedings
**CP475**, 375 (1999). - R. Cabrera-Trujillo, J.R. Sabin, J. Oddershede, and Stephan P. A. Sauer, "The Bethe Sum Rule and Basis Set Quality in the Calculation of Generalized Oscillator Strengths," Adv. Quantum Chem.
**35**, 175 (1999). - R.J. Mathar, S.B. Trickey and J.R. Sabin, "Electronic Stopping of Protons for Lithium in the Dielectric Formulation Obtained from First Principles Band Structures," Nuc. Inst. and Meth. B
**155**, 249 (1999). - J.R. Sabin, S.B. Trickey, S.P. Apell and J. Oddershede, "Molecular Shape, Capacitance, and Chemical Hardness," Int. J. Quantum Chem.
**77**, 358 (2000). - R. Cabrera-Trujillo, J.R. Sabin, Y. Ãƒâ€“hrn, and E. Deumens, "Direct Differential Cross Section Calculations for Ion-Atom and Atom-Atom Collisions in the keV Range," Phys. Rev. A
**61**, 032719 (2000). - S.P. Apell, J. Aizpurua, J.R. Sabin and S.B. Trickey, "Stopping Anisotropy in Molecular Chains," Nuc. Inst. and Meth. B
**164/165**, 318 (2000). - R. Cabrera-Trujillo, E. Deumens, Y. Ohrn, and J.R. Sabin, "Impact Parameter Dependence of Electronic and Nuclear Energy Loss of Swift Ions: H
^{+}? He and H^{+}? H," Nuc. Inst. and Meth. B**168**, 484 (2000). - R. Cabrera-Trujillo, J.R. Sabin, Y. Ãƒâ€“hrn, and E. Deumens, "Charge Exchange and Quantum Effects in the Low Energy Region of Stopping Power," Phys. Rev. Lett.
**84**, 5300 (2000). - S. P. Apell, R. Cabrera-Trujillo, J. Oddershede, S.B. Trickey, and J.R. Sabin, "Effect of Shape on Molecular Directional Compton Profiles," Journal of Molecular Structure (Theochem)
**527**, 157 (2000). - R. Cabrera-Trujillo, J.R. Sabin, Y. Ãƒâ€“hrn, and E. Deumens, "Stopping Cross Sections in the Low- to Intermediate Energy Range: Study of Protons and Hydrogen Atoms on Atomic N, O, and F," Phys. Rev. A,
**62**, 052714 (2000). - J.R. Sabin, "Obituary: Michael Charles Zerner," Adv. Quantum Chem.
**38**, ix (2000). - J.R. Sabin and N. Trinajsti?, "Michael Charles Zerner (1940-2000) - Obituary," Croat. Chem. Acta
**73**, A37 (2000). - P.B. Sabin and J.R. Sabin, "Effects of Confinement on Mean Excitation Energy," Int. J. Quantum Chem.
**82**, 277 (2001). - R. Cabrera-Trujillo, J.R. Sabin, E. Deumens and Y. Ãƒâ€“hrn, "Stopping Cross Section and Charge Exchange Study on the He
^{+}? Ne System," AIP Proceedings,**CP576**, 3 (2001). - S.P. Apell, J.R. Sabin, S.B. Trickey, and J. Oddershede, "Shape Dependent Molecular Polarizabilities," Int. J. Quantum Chem.
**86**, 35 (2002). - R. Cabrera-Trujillo, Y. Ãƒâ€“hrn, J.R. Sabin, and E. Deumens, "Molecular Target and Projectile Angular Scattering Effects in Stopping Power and Charge Exchange at Low to Intermediate Projectile Energies," Phys. Rev. A
**65**, 024901 (2002). - R. Cabrera-Trujillo, Y. Ãƒâ€“hrn, E. Deumens, and J.R. Sabin, "Trajectory and Molecular Binding Effects in Stopping Cross section for Hydrogen Beams on H
_{2}," J. Chem. Phys.**116**, 2783 (2002). - S.A. Malinovskaya, R. Cabrera-Trujillo, John R. Sabin, E. Deumens, and Y. Ãƒâ€“hrn, "Dynamics of proton-acetylene collisions at 30 eV," J. Chem. Phys.
**117**, 1103 (2002). - R. Cabrera-Trujillo, J.R. Sabin, E. Deumens, and Y. Ãƒâ€“hrn, "Stopping Cross Section for N
^{4+}? H at low Projectile Velocity," Phys. Rev. A**66**, 022706 (2002). - Y. Ãƒâ€“hrn and J.R. Sabin, "Introduction to the Memorial Issue for Per-Olov LÃƒÂ¶wdin," Int. J. Quantum Chem.
**90**, 12 (2002). - R. Cabrera-Trujillo, Y. Ãƒâ€“hrn, E. Deumens, J.R. Sabin, and B.G. Lindsay, "Theoretical and Experimental Studies of the H
^{+}? N_{2}System: Differential Cross Sections for Direct and Charge-Transfer Scattering at kilo-electron-Volt Energies," Phys. Rev. A**66**, 042712 (2002). - S.P. Apell, J.R. Sabin, and J. Oddershede, "Molecular Shape and the Bragg Rule," Phys. Rev. A
**66**, 034701 (2002). - J. Linderberg, N. Ãƒâ€“hrn and J.R. Sabin, "Advancing Quantum Chemistry: Per-Olov LÃƒÂ¶wdin 1916 - 2000," Adv. Quantum Chem.
**41**, xi (2002). - E.S. Kryachko and J.R. Sabin, "Quantum Chemical Study of the Hydrogen-Bonded Patterns in the AT Base Pair of DNA: The Origins of Tautomeric Mispairs, Base Flipping, and Watson-Crick Hoogsteen Conversion," Int. J. Quantum Chem.
**91**, 695 (2003). - R. Chancey, L. Oddershede, F.E. Harris, and J.R. Sabin, "Fragmentation of Fullerenes," Phys. Rev. A
**67**, 043203 (7 pages) (2003). [also published in: Virtual Journal of Nanoscale Science and Technology 7/18, (2003).] - R. Cabrera-Trujillo, J.R. Sabin, Y. Ãƒâ€“hrn, and E. Deumens, "Energy Loss Studies of Protons Colliding with Ethane: Preliminary Results," J. Elect. Spectros.
**129**, 303 (2003). - R. Cabrera-Trujillo, J.R. Sabin, Y. Ãƒâ€“hrn, and E. Deumens, "Case for Projectile Energy Gain in Stopping Power Studies," Int. J. Quantum Chem.
**94**, 215 (2003). - L.B. Oddershede, R.T. Chancey, F.E. Harris, and J.R. Sabin, "Fragmentering af fullerener," KVANT No. 2, 3 (2003).
- R. Cabrera-Trujillo, P. Apell, J. Oddershede, and J.R. Sabin, "Why Does the Maximum in the Stopping Cross Section for Protons Occur at Approximately 100 keV Most of the Time?" AIP Proceedings,
**CP680**, 86 (2003). - R. Cabrera-Trujillo, J.R. Sabin, and J. Oddershede, "Explanation of Observed Trend in the Mean Excitation Energy of a Target as Determined Using Several Projectiles," Phys. Rev. A
**68**, 042902 (2003). - R. Cabrera-Trujillo and J.R. Sabin, "The Theory and Computation of Energy Deposition Properties," Adv. Quantum Chem.
**45**, 1 (2004). - R. Cabrera-Trujillo, J.R. Sabin, E. Deumens, and Y. Ãƒâ€“hrn, "Dynamical Processes in Stopping Cross Sections," Adv. Quantum Chem.
**45**, 99 (2004). - R.J. Mathar, S.B. Trickey, and J.R. Sabin, "Electronic Stopping and Momentum Density of Diamond from First-Principles Treatment of the Microscopic Dielectric Function," Adv. Quantum Chem.
**45**, 277 (2004). - R. Cabrera-Trujillo, J. R. Sabin, and J. Oddershede, "Molecular Stopping Powers from the Target Oscillator Strength Distribution," Adv. Quantum Chem.,
**46**, 121 (2004). - R. Cabrera-Trujillo, J.R. Sabin, E. Deumens and Y. Ãƒâ€“hrn, "Calculation of Cross Sections in Electron-Nuclear Dynamics," Adv. Quantum Chem.
**47**, 253 (2004). - R. Cabrera-Trujillo, Y. Ãƒâ€“hrn, E. Deumens, and J.R. Sabin, "Application of the END Theory to the H + D
_{2}? HD + D Reaction," J. Phys. Chem. A**108**, 8935 (2004). - R. Cabrera-Trujillo, Y. Ãƒâ€“hrn, E. Deumens, J.R. Sabin, and B.G. Lindsay, "Absolute Differential and Total Cross Sections for Direct and Charge-Transfer Scattering of keV Protons by O
_{2}," Phys. Rev. A**70**, 042705(9 pages) (2004). - J.A. Nobel, S.B. Trickey, J.R. Sabin, and Jens Oddershede, "Basis Set Limitations on the
*ab initio*Calculation of Stopping Cross-Sections*via*Generalized Oscillator Strengths," Chem. Phys.**309**, 89 (2005). - R. Cabrera-Trujillo, J. R. Sabin, Y. Ohrn, and E. Deumens, "Stopping of Swift Anti-Protons by Hydrogen Atoms and the Barkas Correction," Phys. Rev. A
**71**, 012901(6 pages) (2005). - R. Cabrera-Trujillo, J.R. Sabin, E. Deumens, and Y. Ãƒâ€“hrn, "Prediction of the Energy Dependence of Molecular Fragmentation Cross Sections for Collisions of Swift Protons with Ethane and Acetylene," Phys. Rev. A
**71**, 044702 (4 pages) (2005). - L.B. Oddershede and J.R. Sabin, "Jens Oddershede: Adventurer in Quantum Chemistry," Adv. Quantum Chem.
**48**,*xvii*(2005). - R. Cabrera-Trujillo, J.R. Sabin, E. Deumens, and Y. Ohrn, "Orientational effects in energy deposition by protons in water," Adv. Quantum Chem.
**48**, 47 (2005). - J. Oddershede, J.R. Sabin, and R. Cabrera-Trujillo, "Comparison of shell corrections in the Bohr and Bethe formulations of stopping power," Nuc. Inst. and Meth. B
**241**, 144 (2005). - J.R. Sabin and J. Oddershede, "Stopping Power: What Next?", Adv. Quantum Chem.
**49**, 299 (2005). - S.P.A. Sauer, J. Oddershede, and J.R. Sabin, "Directional Dependence of the Mean Excitation Energy and Spectral Moments of the Dipole Oscillator Strength Distribution of Glycine and its Zwitterion," J. Phys. Chem. A
**110**, 8811 (2006). - J.R. Sabin, "Theoretical Studies of the Interaction of Radiation with Biomolecules," Adv. Quantum Chem.
**52**, 1 (2007). - N. Stolterfoht R. Cabrera-Trujillo, R. Hellhammer, Z. PeÃ…Â¡i?, E. Deumens, Y. Ãƒâ€“hrn, and J.R. Sabin, "Charge Exchange and Fragmentation in Slow Collisions of He
^{2+}with Water Molecules," Adv. Quantum Chem.**52**, 149 (2007). - R. Cabrera-Trujillo, E. Deumens, Y. Ãƒâ€“hrn, O. Quinet, J.R. Sabin, and N. Stolterfoht, "Water-molecule fragmentation induced by charge exchange in slow collisions with He
^{+}and He^{2+}ions in the keV-energy region," Phys. Rev. A**75**, 052702 (2007). - R. Cabrera-Trujillo, J.R. Sabin, E. Deumens, Y. Ãƒâ€“hrn, "Theoretical Investigation of Energy Deposition and Electron Capture Cross-Sections for Helium Ion Impact on Formaldehyde," Nucl. Inst. And Meth. B
**261**, 118 (2007). - N. Stolterfoht, R. Cabrera-Trujillo, Y. Ãƒâ€“hrn, E. Deumens, R. Hoekstra, and J.R. Sabin, "Strong Isotope Effects on the Charge Transfer in Slow Collisions of He
^{2+}with Atomic Hydrogen, Deuterium, and Tritium," Phys. Rev. Lett.**99**, 103201 (2007). - V.V. Albert, J.R. Sabin, and F.E. Harris, "Simulated Structure and Energetics of Endohedral Complexes of Noble Gas Atoms in Buckminsterfullerene," Int. J. Quantum Chem.
**107**, 3061 (2007). - J.R. Sabin, R. Cabrera-Trujillo, L.T. Chadderton, Y. Ãƒâ€“hrn, and E. Deumens, "Directional Aspects of Swift Ion Stopping in a Proto-Biological Molecule: Formaldehyde," AIP Proceedings,
**CP963-V1**, 437 (2007). - F.E. Harris and J.R. Sabin, "Preface: The Nils Yngve Ãƒâ€“hrn Symposium," AIP Proceedings,
**CP963-V2**, 137 (2007). - F.E. Harris and J.R. Sabin, "On a Dynamic Career: A Tribute to Nils Yngve Ãƒâ€“hrn," AIP Proceedings,
**CP963-V2**, 138 (2007). - N. Stolterfoht, R. Cabrera-Trujillo, Y. Ãƒâ€“hrn, E. Deumens, R. Hoekstra, and J.R. Sabin, "Enormous Isotope Effects on the Charge Transfer in Slow Collisions of He
^{2+}with Atomic Hydrogen, Deuterium, and Tritium," AIP Proceedings,**CP963-V2**, 260 (2007). - J.R. Sabin, R. Cabrera-Trujillo, Y. Ãƒâ€“hrn, E. Deumens, "Theoretical Investigation of Fragmentation Effects in the Energy Deposition of Swift Ions in Formaldehyde," J. Phys Conf. Series
**101**, 012009 (2008). - R. Cabrera-Trujillo, J.R. Sabin, E. Deumens, Y. Ãƒâ€“hrn, "Cross sections for H
^{+}and H atoms colliding with Li in the low-keV-energy region," Phys. Rev. A**78**, 012707 (2008). - V.V. Albert, J.R. Sabin, and F.E. Harris, "Simulations of Xe@C
_{60}Collisions with Graphitic Films," Int. J. Quantum Chem.**108**, 3010 (2008). J - R. Sabin and J. Oddershede, "From Stopping Power to Radiation Dose Equivalent: Views of the Interaction of Swift Ions with Matter," AIP Proceedings
**CP1080**, 30 (2008). - J.R. Sabin, J. Oddershede, and S.P.A. Sauer, "Amino Acid Mean Excitation Energies and Directional Dependencies from Core and Bond Calculations," AIP Proceedings
**CP1080**, 138 (2008). - J.R. Sabin, R. Cabrerra-Trujillo, N. Stolterfoht, E. Deumens, and Y. Ãƒâ€“hrn, "Fragmentation of Water on Swift
^{3}He^{2+}Ion Impact," Nucl. Inst. and Meth. B**267**, 196 (2009). - J.R. Sabin and Y. Ãƒâ€“hrn, "Frank E. Harris: The First 80 Years," Int. J. Quantum Chem.
**109**, 2801 (2009). - J.R. Sabin and J. Oddershede, "An Analytical Representation of Shell Corrections for Stopping Power," Int. J. Quantum Chem.
**109**, 2933 (2009). - N. Stolterfoht, R. Cabrera-Trujillo, P.S. Krsti?, Y. Ãƒâ€“hrn, E. Deumens, and J.R. Sabin, "Stueckelberg Oscillations in the Charge Transfer into the n=2 and n=3 Shells of He
^{2+}on collision with H," Int. J. Quantum Chem.**109**, 3063 (2009). - N. L. Guevara, B. Hall, E. Teixeira, J. R. Sabin, E. Deumens and Y. Ãƒâ€“hrn, "Construction of Basis Sets for Time Dependent Studies," J. Chem. Phys.
**131**, 064104 (2009). - V.V. Albert, N.L. Guevara, J.R. Sabin, and F.E. Harris, "Few-Parameter Exponentially Correlated Wavefunctions for the Ground State of Lithium," Int. J. Quantum Chem.
**109**, 3791 (2009). - Kestutis Aidas, Jacob Kongsted, John R. Sabin, Jens Oddershede,
Kurt V. Mikkelsen, and Stephan P. A. Sauer, "The Effect of Solvation on the Mean Excitation Energy of Glycine," Phys. Chem. Lett.
**1**, 242 (2009). - N. L. Guevara, E. Teixeira, B. Hall, E. Deumens, Y. Ãƒâ€“hrn, and J. R. Sabin, "Study of Multiple Electron Transfer Processes in Collisions of N
^{6+}and O^{7+}with Methane," Phys. Rev. A**80**, 062715 (8 pages) (2009) - J.R. Sabin, F. Gregory, and N. Jeppesen, "The Quantum Ten: A story of Passion, Tragedy, Ambition, and Science," Book Review, Int. J. Quantum Chem. 110, 960 (2009).
- S. Bruun-Ghalbia, S.P.A. Sauer, J. Oddershede, and J.R. Sabin, "Mean Excitation Energies and Energy Deposition Characteristics of Bio-organic Molecules," J. Phys. Chem. B 144, 633 (2010).