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Papers with H. F. Schaefer

  1. J. C. Hargis, H. F. Schaefer, K. N. Houk, and S. E. Wheeler, "Non-Covalent Interactions of a Benzo[a]pyrene Diol Epoxide with DNA Base Pairs: Insight into the Formation of Adducts of (+)-BaP DE-2 with DNA", J. Phys. Chem. A 114, 2038 (2010).
  2. S. E. Wheeler and H. F. Schaefer, "Thermochemistry of the HOSO Radical, a Key Intermediate in Fossil Fuel Combustion", J. Phys. Chem. A 113, 6779 (2009).
  3. S. E. Wheeler, W. D. Allen, and H. F. Schaefer, "On the Convergence of Z-averaged Perturbation Theory (ZAPT)", J. Chem. Phys. 128, 74107 (2008).
  4. L. Belau, S. E. Wheeler, B. W. Ticknor, M. Ahmed, S. E. Leone, W. D. Allen, H. F. Schaefer, and M. A. Duncan, "Ionization Thresholds of Small Carbon Clusters: Tunable VUV Experiments and Theory", J. Am. Chem. Soc. 129, 10229 (2007).
  5. M. C. Lind, N. A. Richardson, S. E. Wheeler, and H. F. Schaefer, "Hydrogen Abstracted Adenine-Thymine Radicals with Interesting Transferable Properties", J. Phys. Chem. B 111, 5525 (2007).
  6. S. E. Wheeler, A. C. Simmonett, and H. F. Schaefer, "The Renner-Teller Bending Frequencies of the A 2Π State of OCS+", J. Phys. Chem. A 111, 4551 (2007).
  7. S. E. Wheeler, K. A. Robertson, W. D. Allen, H. F. Schaefer, Y. J. Bomble, and J. F. Stanton, "Thermochemistry of Key Soot Formation Intermediates: C3H3 Isomers", J. Phys. Chem. A 111, 3819 (2007).
  8. S. E. Wheeler, P. v. R. Schleyer, and H. F. Schaefer, "SASS: A Symmetry Adapted Stochastic Search Algorithm Exploiting Site Symmetry", J. Chem. Phys. 126, 104104 (2007).
  9. S. Kim, S. E. Wheeler, and H. F. Schaefer, "Microsolvation Effects on the Electron Capturing Ability of Thymine: Thymine-Water Complexes", J. Chem. Phys. 124, 204310 (2006).
  10. M. C. Lind, P. P. Bera, N. A. Richardson, S. E. Wheeler, and H. F. Schaefer, "The Deprotonated Guanine-Cytosine Base Pair", Proc. Natl. Acad. Sci. USA 103, 7554 (2006).
  11. X. Zhang, Q. Li, J. B. Ingels, A. C. Simmonett, S. E. Wheeler, Y. Xie, R. B. King, H. F. Schaefer, and F. A. Cotton, "The Remarkable Electron Accepting Properties of the Simplest Benzenoid Cyanocarbons: Hexacyanobenzene, Octacyanonaphthalene, and Decacyanoanthracene", Chem. Commun. 0, 758 (2006).
  12. S. E. Wheeler, Y. Yamaguchi, and H. F. Schaefer, "Protonated Carbonyl Sulfide: Prospects for the Spectroscopic Identification of the Elusive HSCO+ Isomer", J. Chem. Phys. 124, 44322 (2006).
  13. R. L. Lord, S. E. Wheeler, and H. F. Schaefer, "The Pentacyanocyclopentadienyl System: Structures and Energetics", J. Phys. Chem. A 109, 10084 (2005).
  14. S. E. Wheeler and H. F. Schaefer, "Ionization Potentials of Small Lithium Clusters (Lin) and Hydrogenated Lithium Clusters (LinH)", J. Chem. Phys. 122, 204328 (2005).
  15. Q. Luo, J. Li, Q. S. Li, S. Kim, S. E. Wheeler, Y. Xie, and H. F. Schaefer, "Electron Affinities of the Radicals Derived from Cytosine", Phys. Chem. Chem. Phys. 7, 861 (2005).
  16. S. E. Wheeler, W. D. Allen, and H. F. Schaefer, "Thermochemistry of Disputed Soot Formation Intermediates C4H3 and C4H5", J. Chem. Phys. 121, 8800 (2004).
  17. S. E. Wheeler, K. W. Sattelmeyer, P. v. R. Schleyer, and H. F. Schaefer, "Dissociation Energies of Small Lithium Clusters (Lin) and Hydrogenated Lithium Clusters (LinH)", J. Chem. Phys. 120, 4683 (2004).
  18. A. C. Simmonett, S. E. Wheeler, and H. F. Schaefer, "The Vinyl Radical and Fluorinated Vinyl Radicals, C2H3-nFn (n = 0-3), and Corresponding Anions: Comparison with the Isoelectronic Complexes [X•••YC≡CZ]-", J. Phys. Chem. A 108, 1608 (2004).